84 6804 = orbitals in unit cell and supercell. See end of file. io ia is spec iao n l m z p sym rc isc iuo 1 1 3 Te 1 5 0 0 1 F s 6.195 0 0 0 1 2 1 3 Te 2 5 0 0 2 F s 4.205 0 0 0 2 3 1 3 Te 3 5 1 -1 1 F py 8.156 0 0 0 3 4 1 3 Te 4 5 1 0 1 F pz 8.156 0 0 0 4 5 1 3 Te 5 5 1 1 1 F px 8.156 0 0 0 5 6 1 3 Te 6 5 1 -1 2 F py 5.009 0 0 0 6 7 1 3 Te 7 5 1 0 2 F pz 5.009 0 0 0 7 8 1 3 Te 8 5 1 1 2 F px 5.009 0 0 0 8 9 1 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 0 0 9 10 1 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 0 0 10 11 1 3 Te 11 5 2 0 1 T Pdz2 8.156 0 0 0 11 12 1 3 Te 12 5 2 1 1 T Pdxz 8.156 0 0 0 12 13 1 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 0 0 13 14 2 3 Te 1 5 0 0 1 F s 6.195 0 0 0 14 15 2 3 Te 2 5 0 0 2 F s 4.205 0 0 0 15 16 2 3 Te 3 5 1 -1 1 F py 8.156 0 0 0 16 17 2 3 Te 4 5 1 0 1 F pz 8.156 0 0 0 17 18 2 3 Te 5 5 1 1 1 F px 8.156 0 0 0 18 19 2 3 Te 6 5 1 -1 2 F py 5.009 0 0 0 19 20 2 3 Te 7 5 1 0 2 F pz 5.009 0 0 0 20 21 2 3 Te 8 5 1 1 2 F px 5.009 0 0 0 21 22 2 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 0 0 22 23 2 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 0 0 23 24 2 3 Te 11 5 2 0 1 T Pdz2 8.156 0 0 0 24 25 2 3 Te 12 5 2 1 1 T Pdxz 8.156 0 0 0 25 26 2 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 0 0 26 27 3 2 Ge 1 4 0 0 1 F s 6.581 0 0 0 27 28 3 2 Ge 2 4 0 0 2 F s 4.412 0 0 0 28 29 3 2 Ge 3 4 1 -1 1 F py 9.340 0 0 0 29 30 3 2 Ge 4 4 1 0 1 F pz 9.340 0 0 0 30 31 3 2 Ge 5 4 1 1 1 F px 9.340 0 0 0 31 32 3 2 Ge 6 4 1 -1 2 F py 5.665 0 0 0 32 33 3 2 Ge 7 4 1 0 2 F pz 5.665 0 0 0 33 34 3 2 Ge 8 4 1 1 2 F px 5.665 0 0 0 34 35 3 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 0 0 35 36 3 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 0 0 36 37 3 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 0 0 37 38 3 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 0 0 38 39 3 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 0 0 39 40 4 1 Fe 1 4 0 0 1 F s 9.649 0 0 0 40 41 4 1 Fe 2 4 0 0 2 F s 6.885 0 0 0 41 42 4 1 Fe 3 3 2 -2 1 F dxy 6.632 0 0 0 42 43 4 1 Fe 4 3 2 -1 1 F dyz 6.632 0 0 0 43 44 4 1 Fe 5 3 2 0 1 F dz2 6.632 0 0 0 44 45 4 1 Fe 6 3 2 1 1 F dxz 6.632 0 0 0 45 46 4 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 0 0 46 47 4 1 Fe 8 3 2 -2 2 F dxy 2.565 0 0 0 47 48 4 1 Fe 9 3 2 -1 2 F dyz 2.565 0 0 0 48 49 4 1 Fe 10 3 2 0 2 F dz2 2.565 0 0 0 49 50 4 1 Fe 11 3 2 1 2 F dxz 2.565 0 0 0 50 51 4 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 0 0 51 52 4 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 0 0 52 53 4 1 Fe 14 4 1 0 1 T Ppz 9.649 0 0 0 53 54 4 1 Fe 15 4 1 1 1 T Ppx 9.649 0 0 0 54 55 5 1 Fe 1 4 0 0 1 F s 9.649 0 0 0 55 56 5 1 Fe 2 4 0 0 2 F s 6.885 0 0 0 56 57 5 1 Fe 3 3 2 -2 1 F dxy 6.632 0 0 0 57 58 5 1 Fe 4 3 2 -1 1 F dyz 6.632 0 0 0 58 59 5 1 Fe 5 3 2 0 1 F dz2 6.632 0 0 0 59 60 5 1 Fe 6 3 2 1 1 F dxz 6.632 0 0 0 60 61 5 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 0 0 61 62 5 1 Fe 8 3 2 -2 2 F dxy 2.565 0 0 0 62 63 5 1 Fe 9 3 2 -1 2 F dyz 2.565 0 0 0 63 64 5 1 Fe 10 3 2 0 2 F dz2 2.565 0 0 0 64 65 5 1 Fe 11 3 2 1 2 F dxz 2.565 0 0 0 65 66 5 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 0 0 66 67 5 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 0 0 67 68 5 1 Fe 14 4 1 0 1 T Ppz 9.649 0 0 0 68 69 5 1 Fe 15 4 1 1 1 T Ppx 9.649 0 0 0 69 70 6 1 Fe 1 4 0 0 1 F s 9.649 0 0 0 70 71 6 1 Fe 2 4 0 0 2 F s 6.885 0 0 0 71 72 6 1 Fe 3 3 2 -2 1 F dxy 6.632 0 0 0 72 73 6 1 Fe 4 3 2 -1 1 F dyz 6.632 0 0 0 73 74 6 1 Fe 5 3 2 0 1 F dz2 6.632 0 0 0 74 75 6 1 Fe 6 3 2 1 1 F dxz 6.632 0 0 0 75 76 6 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 0 0 76 77 6 1 Fe 8 3 2 -2 2 F dxy 2.565 0 0 0 77 78 6 1 Fe 9 3 2 -1 2 F dyz 2.565 0 0 0 78 79 6 1 Fe 10 3 2 0 2 F dz2 2.565 0 0 0 79 80 6 1 Fe 11 3 2 1 2 F dxz 2.565 0 0 0 80 81 6 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 0 0 81 82 6 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 0 0 82 83 6 1 Fe 14 4 1 0 1 T Ppz 9.649 0 0 0 83 84 6 1 Fe 15 4 1 1 1 T Ppx 9.649 0 0 0 84 85 7 3 Te 1 5 0 0 1 F s 6.195 1 0 0 1 86 7 3 Te 2 5 0 0 2 F s 4.205 1 0 0 2 87 7 3 Te 3 5 1 -1 1 F py 8.156 1 0 0 3 88 7 3 Te 4 5 1 0 1 F pz 8.156 1 0 0 4 89 7 3 Te 5 5 1 1 1 F px 8.156 1 0 0 5 90 7 3 Te 6 5 1 -1 2 F py 5.009 1 0 0 6 91 7 3 Te 7 5 1 0 2 F pz 5.009 1 0 0 7 92 7 3 Te 8 5 1 1 2 F px 5.009 1 0 0 8 93 7 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 0 0 9 94 7 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 0 0 10 95 7 3 Te 11 5 2 0 1 T Pdz2 8.156 1 0 0 11 96 7 3 Te 12 5 2 1 1 T Pdxz 8.156 1 0 0 12 97 7 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 0 0 13 98 8 3 Te 1 5 0 0 1 F s 6.195 1 0 0 14 99 8 3 Te 2 5 0 0 2 F s 4.205 1 0 0 15 100 8 3 Te 3 5 1 -1 1 F py 8.156 1 0 0 16 101 8 3 Te 4 5 1 0 1 F pz 8.156 1 0 0 17 102 8 3 Te 5 5 1 1 1 F px 8.156 1 0 0 18 103 8 3 Te 6 5 1 -1 2 F py 5.009 1 0 0 19 104 8 3 Te 7 5 1 0 2 F pz 5.009 1 0 0 20 105 8 3 Te 8 5 1 1 2 F px 5.009 1 0 0 21 106 8 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 0 0 22 107 8 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 0 0 23 108 8 3 Te 11 5 2 0 1 T Pdz2 8.156 1 0 0 24 109 8 3 Te 12 5 2 1 1 T Pdxz 8.156 1 0 0 25 110 8 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 0 0 26 111 9 2 Ge 1 4 0 0 1 F s 6.581 1 0 0 27 112 9 2 Ge 2 4 0 0 2 F s 4.412 1 0 0 28 113 9 2 Ge 3 4 1 -1 1 F py 9.340 1 0 0 29 114 9 2 Ge 4 4 1 0 1 F pz 9.340 1 0 0 30 115 9 2 Ge 5 4 1 1 1 F px 9.340 1 0 0 31 116 9 2 Ge 6 4 1 -1 2 F py 5.665 1 0 0 32 117 9 2 Ge 7 4 1 0 2 F pz 5.665 1 0 0 33 118 9 2 Ge 8 4 1 1 2 F px 5.665 1 0 0 34 119 9 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 0 0 35 120 9 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 0 0 36 121 9 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 0 0 37 122 9 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 0 0 38 123 9 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 0 0 39 124 10 1 Fe 1 4 0 0 1 F s 9.649 1 0 0 40 125 10 1 Fe 2 4 0 0 2 F s 6.885 1 0 0 41 126 10 1 Fe 3 3 2 -2 1 F dxy 6.632 1 0 0 42 127 10 1 Fe 4 3 2 -1 1 F dyz 6.632 1 0 0 43 128 10 1 Fe 5 3 2 0 1 F dz2 6.632 1 0 0 44 129 10 1 Fe 6 3 2 1 1 F dxz 6.632 1 0 0 45 130 10 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 0 0 46 131 10 1 Fe 8 3 2 -2 2 F dxy 2.565 1 0 0 47 132 10 1 Fe 9 3 2 -1 2 F dyz 2.565 1 0 0 48 133 10 1 Fe 10 3 2 0 2 F dz2 2.565 1 0 0 49 134 10 1 Fe 11 3 2 1 2 F dxz 2.565 1 0 0 50 135 10 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 0 0 51 136 10 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 0 0 52 137 10 1 Fe 14 4 1 0 1 T Ppz 9.649 1 0 0 53 138 10 1 Fe 15 4 1 1 1 T Ppx 9.649 1 0 0 54 139 11 1 Fe 1 4 0 0 1 F s 9.649 1 0 0 55 140 11 1 Fe 2 4 0 0 2 F s 6.885 1 0 0 56 141 11 1 Fe 3 3 2 -2 1 F dxy 6.632 1 0 0 57 142 11 1 Fe 4 3 2 -1 1 F dyz 6.632 1 0 0 58 143 11 1 Fe 5 3 2 0 1 F dz2 6.632 1 0 0 59 144 11 1 Fe 6 3 2 1 1 F dxz 6.632 1 0 0 60 145 11 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 0 0 61 146 11 1 Fe 8 3 2 -2 2 F dxy 2.565 1 0 0 62 147 11 1 Fe 9 3 2 -1 2 F dyz 2.565 1 0 0 63 148 11 1 Fe 10 3 2 0 2 F dz2 2.565 1 0 0 64 149 11 1 Fe 11 3 2 1 2 F dxz 2.565 1 0 0 65 150 11 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 0 0 66 151 11 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 0 0 67 152 11 1 Fe 14 4 1 0 1 T Ppz 9.649 1 0 0 68 153 11 1 Fe 15 4 1 1 1 T Ppx 9.649 1 0 0 69 154 12 1 Fe 1 4 0 0 1 F s 9.649 1 0 0 70 155 12 1 Fe 2 4 0 0 2 F s 6.885 1 0 0 71 156 12 1 Fe 3 3 2 -2 1 F dxy 6.632 1 0 0 72 157 12 1 Fe 4 3 2 -1 1 F dyz 6.632 1 0 0 73 158 12 1 Fe 5 3 2 0 1 F dz2 6.632 1 0 0 74 159 12 1 Fe 6 3 2 1 1 F dxz 6.632 1 0 0 75 160 12 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 0 0 76 161 12 1 Fe 8 3 2 -2 2 F dxy 2.565 1 0 0 77 162 12 1 Fe 9 3 2 -1 2 F dyz 2.565 1 0 0 78 163 12 1 Fe 10 3 2 0 2 F dz2 2.565 1 0 0 79 164 12 1 Fe 11 3 2 1 2 F dxz 2.565 1 0 0 80 165 12 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 0 0 81 166 12 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 0 0 82 167 12 1 Fe 14 4 1 0 1 T Ppz 9.649 1 0 0 83 168 12 1 Fe 15 4 1 1 1 T Ppx 9.649 1 0 0 84 169 13 3 Te 1 5 0 0 1 F s 6.195 2 0 0 1 170 13 3 Te 2 5 0 0 2 F s 4.205 2 0 0 2 171 13 3 Te 3 5 1 -1 1 F py 8.156 2 0 0 3 172 13 3 Te 4 5 1 0 1 F pz 8.156 2 0 0 4 173 13 3 Te 5 5 1 1 1 F px 8.156 2 0 0 5 174 13 3 Te 6 5 1 -1 2 F py 5.009 2 0 0 6 175 13 3 Te 7 5 1 0 2 F pz 5.009 2 0 0 7 176 13 3 Te 8 5 1 1 2 F px 5.009 2 0 0 8 177 13 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 0 0 9 178 13 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 0 0 10 179 13 3 Te 11 5 2 0 1 T Pdz2 8.156 2 0 0 11 180 13 3 Te 12 5 2 1 1 T Pdxz 8.156 2 0 0 12 181 13 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 0 0 13 182 14 3 Te 1 5 0 0 1 F s 6.195 2 0 0 14 183 14 3 Te 2 5 0 0 2 F s 4.205 2 0 0 15 184 14 3 Te 3 5 1 -1 1 F py 8.156 2 0 0 16 185 14 3 Te 4 5 1 0 1 F pz 8.156 2 0 0 17 186 14 3 Te 5 5 1 1 1 F px 8.156 2 0 0 18 187 14 3 Te 6 5 1 -1 2 F py 5.009 2 0 0 19 188 14 3 Te 7 5 1 0 2 F pz 5.009 2 0 0 20 189 14 3 Te 8 5 1 1 2 F px 5.009 2 0 0 21 190 14 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 0 0 22 191 14 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 0 0 23 192 14 3 Te 11 5 2 0 1 T Pdz2 8.156 2 0 0 24 193 14 3 Te 12 5 2 1 1 T Pdxz 8.156 2 0 0 25 194 14 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 0 0 26 195 15 2 Ge 1 4 0 0 1 F s 6.581 2 0 0 27 196 15 2 Ge 2 4 0 0 2 F s 4.412 2 0 0 28 197 15 2 Ge 3 4 1 -1 1 F py 9.340 2 0 0 29 198 15 2 Ge 4 4 1 0 1 F pz 9.340 2 0 0 30 199 15 2 Ge 5 4 1 1 1 F px 9.340 2 0 0 31 200 15 2 Ge 6 4 1 -1 2 F py 5.665 2 0 0 32 201 15 2 Ge 7 4 1 0 2 F pz 5.665 2 0 0 33 202 15 2 Ge 8 4 1 1 2 F px 5.665 2 0 0 34 203 15 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 0 0 35 204 15 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 0 0 36 205 15 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 0 0 37 206 15 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 0 0 38 207 15 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 0 0 39 208 16 1 Fe 1 4 0 0 1 F s 9.649 2 0 0 40 209 16 1 Fe 2 4 0 0 2 F s 6.885 2 0 0 41 210 16 1 Fe 3 3 2 -2 1 F dxy 6.632 2 0 0 42 211 16 1 Fe 4 3 2 -1 1 F dyz 6.632 2 0 0 43 212 16 1 Fe 5 3 2 0 1 F dz2 6.632 2 0 0 44 213 16 1 Fe 6 3 2 1 1 F dxz 6.632 2 0 0 45 214 16 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 0 0 46 215 16 1 Fe 8 3 2 -2 2 F dxy 2.565 2 0 0 47 216 16 1 Fe 9 3 2 -1 2 F dyz 2.565 2 0 0 48 217 16 1 Fe 10 3 2 0 2 F dz2 2.565 2 0 0 49 218 16 1 Fe 11 3 2 1 2 F dxz 2.565 2 0 0 50 219 16 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 0 0 51 220 16 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 0 0 52 221 16 1 Fe 14 4 1 0 1 T Ppz 9.649 2 0 0 53 222 16 1 Fe 15 4 1 1 1 T Ppx 9.649 2 0 0 54 223 17 1 Fe 1 4 0 0 1 F s 9.649 2 0 0 55 224 17 1 Fe 2 4 0 0 2 F s 6.885 2 0 0 56 225 17 1 Fe 3 3 2 -2 1 F dxy 6.632 2 0 0 57 226 17 1 Fe 4 3 2 -1 1 F dyz 6.632 2 0 0 58 227 17 1 Fe 5 3 2 0 1 F dz2 6.632 2 0 0 59 228 17 1 Fe 6 3 2 1 1 F dxz 6.632 2 0 0 60 229 17 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 0 0 61 230 17 1 Fe 8 3 2 -2 2 F dxy 2.565 2 0 0 62 231 17 1 Fe 9 3 2 -1 2 F dyz 2.565 2 0 0 63 232 17 1 Fe 10 3 2 0 2 F dz2 2.565 2 0 0 64 233 17 1 Fe 11 3 2 1 2 F dxz 2.565 2 0 0 65 234 17 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 0 0 66 235 17 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 0 0 67 236 17 1 Fe 14 4 1 0 1 T Ppz 9.649 2 0 0 68 237 17 1 Fe 15 4 1 1 1 T Ppx 9.649 2 0 0 69 238 18 1 Fe 1 4 0 0 1 F s 9.649 2 0 0 70 239 18 1 Fe 2 4 0 0 2 F s 6.885 2 0 0 71 240 18 1 Fe 3 3 2 -2 1 F dxy 6.632 2 0 0 72 241 18 1 Fe 4 3 2 -1 1 F dyz 6.632 2 0 0 73 242 18 1 Fe 5 3 2 0 1 F dz2 6.632 2 0 0 74 243 18 1 Fe 6 3 2 1 1 F dxz 6.632 2 0 0 75 244 18 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 0 0 76 245 18 1 Fe 8 3 2 -2 2 F dxy 2.565 2 0 0 77 246 18 1 Fe 9 3 2 -1 2 F dyz 2.565 2 0 0 78 247 18 1 Fe 10 3 2 0 2 F dz2 2.565 2 0 0 79 248 18 1 Fe 11 3 2 1 2 F dxz 2.565 2 0 0 80 249 18 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 0 0 81 250 18 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 0 0 82 251 18 1 Fe 14 4 1 0 1 T Ppz 9.649 2 0 0 83 252 18 1 Fe 15 4 1 1 1 T Ppx 9.649 2 0 0 84 253 19 3 Te 1 5 0 0 1 F s 6.195 3 0 0 1 254 19 3 Te 2 5 0 0 2 F s 4.205 3 0 0 2 255 19 3 Te 3 5 1 -1 1 F py 8.156 3 0 0 3 256 19 3 Te 4 5 1 0 1 F pz 8.156 3 0 0 4 257 19 3 Te 5 5 1 1 1 F px 8.156 3 0 0 5 258 19 3 Te 6 5 1 -1 2 F py 5.009 3 0 0 6 259 19 3 Te 7 5 1 0 2 F pz 5.009 3 0 0 7 260 19 3 Te 8 5 1 1 2 F px 5.009 3 0 0 8 261 19 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 0 0 9 262 19 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 0 0 10 263 19 3 Te 11 5 2 0 1 T Pdz2 8.156 3 0 0 11 264 19 3 Te 12 5 2 1 1 T Pdxz 8.156 3 0 0 12 265 19 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 0 0 13 266 20 3 Te 1 5 0 0 1 F s 6.195 3 0 0 14 267 20 3 Te 2 5 0 0 2 F s 4.205 3 0 0 15 268 20 3 Te 3 5 1 -1 1 F py 8.156 3 0 0 16 269 20 3 Te 4 5 1 0 1 F pz 8.156 3 0 0 17 270 20 3 Te 5 5 1 1 1 F px 8.156 3 0 0 18 271 20 3 Te 6 5 1 -1 2 F py 5.009 3 0 0 19 272 20 3 Te 7 5 1 0 2 F pz 5.009 3 0 0 20 273 20 3 Te 8 5 1 1 2 F px 5.009 3 0 0 21 274 20 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 0 0 22 275 20 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 0 0 23 276 20 3 Te 11 5 2 0 1 T Pdz2 8.156 3 0 0 24 277 20 3 Te 12 5 2 1 1 T Pdxz 8.156 3 0 0 25 278 20 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 0 0 26 279 21 2 Ge 1 4 0 0 1 F s 6.581 3 0 0 27 280 21 2 Ge 2 4 0 0 2 F s 4.412 3 0 0 28 281 21 2 Ge 3 4 1 -1 1 F py 9.340 3 0 0 29 282 21 2 Ge 4 4 1 0 1 F pz 9.340 3 0 0 30 283 21 2 Ge 5 4 1 1 1 F px 9.340 3 0 0 31 284 21 2 Ge 6 4 1 -1 2 F py 5.665 3 0 0 32 285 21 2 Ge 7 4 1 0 2 F pz 5.665 3 0 0 33 286 21 2 Ge 8 4 1 1 2 F px 5.665 3 0 0 34 287 21 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 0 0 35 288 21 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 0 0 36 289 21 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 0 0 37 290 21 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 0 0 38 291 21 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 0 0 39 292 22 1 Fe 1 4 0 0 1 F s 9.649 3 0 0 40 293 22 1 Fe 2 4 0 0 2 F s 6.885 3 0 0 41 294 22 1 Fe 3 3 2 -2 1 F dxy 6.632 3 0 0 42 295 22 1 Fe 4 3 2 -1 1 F dyz 6.632 3 0 0 43 296 22 1 Fe 5 3 2 0 1 F dz2 6.632 3 0 0 44 297 22 1 Fe 6 3 2 1 1 F dxz 6.632 3 0 0 45 298 22 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 0 0 46 299 22 1 Fe 8 3 2 -2 2 F dxy 2.565 3 0 0 47 300 22 1 Fe 9 3 2 -1 2 F dyz 2.565 3 0 0 48 301 22 1 Fe 10 3 2 0 2 F dz2 2.565 3 0 0 49 302 22 1 Fe 11 3 2 1 2 F dxz 2.565 3 0 0 50 303 22 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 0 0 51 304 22 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 0 0 52 305 22 1 Fe 14 4 1 0 1 T Ppz 9.649 3 0 0 53 306 22 1 Fe 15 4 1 1 1 T Ppx 9.649 3 0 0 54 307 23 1 Fe 1 4 0 0 1 F s 9.649 3 0 0 55 308 23 1 Fe 2 4 0 0 2 F s 6.885 3 0 0 56 309 23 1 Fe 3 3 2 -2 1 F dxy 6.632 3 0 0 57 310 23 1 Fe 4 3 2 -1 1 F dyz 6.632 3 0 0 58 311 23 1 Fe 5 3 2 0 1 F dz2 6.632 3 0 0 59 312 23 1 Fe 6 3 2 1 1 F dxz 6.632 3 0 0 60 313 23 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 0 0 61 314 23 1 Fe 8 3 2 -2 2 F dxy 2.565 3 0 0 62 315 23 1 Fe 9 3 2 -1 2 F dyz 2.565 3 0 0 63 316 23 1 Fe 10 3 2 0 2 F dz2 2.565 3 0 0 64 317 23 1 Fe 11 3 2 1 2 F dxz 2.565 3 0 0 65 318 23 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 0 0 66 319 23 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 0 0 67 320 23 1 Fe 14 4 1 0 1 T Ppz 9.649 3 0 0 68 321 23 1 Fe 15 4 1 1 1 T Ppx 9.649 3 0 0 69 322 24 1 Fe 1 4 0 0 1 F s 9.649 3 0 0 70 323 24 1 Fe 2 4 0 0 2 F s 6.885 3 0 0 71 324 24 1 Fe 3 3 2 -2 1 F dxy 6.632 3 0 0 72 325 24 1 Fe 4 3 2 -1 1 F dyz 6.632 3 0 0 73 326 24 1 Fe 5 3 2 0 1 F dz2 6.632 3 0 0 74 327 24 1 Fe 6 3 2 1 1 F dxz 6.632 3 0 0 75 328 24 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 0 0 76 329 24 1 Fe 8 3 2 -2 2 F dxy 2.565 3 0 0 77 330 24 1 Fe 9 3 2 -1 2 F dyz 2.565 3 0 0 78 331 24 1 Fe 10 3 2 0 2 F dz2 2.565 3 0 0 79 332 24 1 Fe 11 3 2 1 2 F dxz 2.565 3 0 0 80 333 24 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 0 0 81 334 24 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 0 0 82 335 24 1 Fe 14 4 1 0 1 T Ppz 9.649 3 0 0 83 336 24 1 Fe 15 4 1 1 1 T Ppx 9.649 3 0 0 84 337 25 3 Te 1 5 0 0 1 F s 6.195 4 0 0 1 338 25 3 Te 2 5 0 0 2 F s 4.205 4 0 0 2 339 25 3 Te 3 5 1 -1 1 F py 8.156 4 0 0 3 340 25 3 Te 4 5 1 0 1 F pz 8.156 4 0 0 4 341 25 3 Te 5 5 1 1 1 F px 8.156 4 0 0 5 342 25 3 Te 6 5 1 -1 2 F py 5.009 4 0 0 6 343 25 3 Te 7 5 1 0 2 F pz 5.009 4 0 0 7 344 25 3 Te 8 5 1 1 2 F px 5.009 4 0 0 8 345 25 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 0 0 9 346 25 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 0 0 10 347 25 3 Te 11 5 2 0 1 T Pdz2 8.156 4 0 0 11 348 25 3 Te 12 5 2 1 1 T Pdxz 8.156 4 0 0 12 349 25 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 0 0 13 350 26 3 Te 1 5 0 0 1 F s 6.195 4 0 0 14 351 26 3 Te 2 5 0 0 2 F s 4.205 4 0 0 15 352 26 3 Te 3 5 1 -1 1 F py 8.156 4 0 0 16 353 26 3 Te 4 5 1 0 1 F pz 8.156 4 0 0 17 354 26 3 Te 5 5 1 1 1 F px 8.156 4 0 0 18 355 26 3 Te 6 5 1 -1 2 F py 5.009 4 0 0 19 356 26 3 Te 7 5 1 0 2 F pz 5.009 4 0 0 20 357 26 3 Te 8 5 1 1 2 F px 5.009 4 0 0 21 358 26 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 0 0 22 359 26 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 0 0 23 360 26 3 Te 11 5 2 0 1 T Pdz2 8.156 4 0 0 24 361 26 3 Te 12 5 2 1 1 T Pdxz 8.156 4 0 0 25 362 26 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 0 0 26 363 27 2 Ge 1 4 0 0 1 F s 6.581 4 0 0 27 364 27 2 Ge 2 4 0 0 2 F s 4.412 4 0 0 28 365 27 2 Ge 3 4 1 -1 1 F py 9.340 4 0 0 29 366 27 2 Ge 4 4 1 0 1 F pz 9.340 4 0 0 30 367 27 2 Ge 5 4 1 1 1 F px 9.340 4 0 0 31 368 27 2 Ge 6 4 1 -1 2 F py 5.665 4 0 0 32 369 27 2 Ge 7 4 1 0 2 F pz 5.665 4 0 0 33 370 27 2 Ge 8 4 1 1 2 F px 5.665 4 0 0 34 371 27 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 0 0 35 372 27 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 0 0 36 373 27 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 0 0 37 374 27 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 0 0 38 375 27 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 0 0 39 376 28 1 Fe 1 4 0 0 1 F s 9.649 4 0 0 40 377 28 1 Fe 2 4 0 0 2 F s 6.885 4 0 0 41 378 28 1 Fe 3 3 2 -2 1 F dxy 6.632 4 0 0 42 379 28 1 Fe 4 3 2 -1 1 F dyz 6.632 4 0 0 43 380 28 1 Fe 5 3 2 0 1 F dz2 6.632 4 0 0 44 381 28 1 Fe 6 3 2 1 1 F dxz 6.632 4 0 0 45 382 28 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 0 0 46 383 28 1 Fe 8 3 2 -2 2 F dxy 2.565 4 0 0 47 384 28 1 Fe 9 3 2 -1 2 F dyz 2.565 4 0 0 48 385 28 1 Fe 10 3 2 0 2 F dz2 2.565 4 0 0 49 386 28 1 Fe 11 3 2 1 2 F dxz 2.565 4 0 0 50 387 28 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 0 0 51 388 28 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 0 0 52 389 28 1 Fe 14 4 1 0 1 T Ppz 9.649 4 0 0 53 390 28 1 Fe 15 4 1 1 1 T Ppx 9.649 4 0 0 54 391 29 1 Fe 1 4 0 0 1 F s 9.649 4 0 0 55 392 29 1 Fe 2 4 0 0 2 F s 6.885 4 0 0 56 393 29 1 Fe 3 3 2 -2 1 F dxy 6.632 4 0 0 57 394 29 1 Fe 4 3 2 -1 1 F dyz 6.632 4 0 0 58 395 29 1 Fe 5 3 2 0 1 F dz2 6.632 4 0 0 59 396 29 1 Fe 6 3 2 1 1 F dxz 6.632 4 0 0 60 397 29 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 0 0 61 398 29 1 Fe 8 3 2 -2 2 F dxy 2.565 4 0 0 62 399 29 1 Fe 9 3 2 -1 2 F dyz 2.565 4 0 0 63 400 29 1 Fe 10 3 2 0 2 F dz2 2.565 4 0 0 64 401 29 1 Fe 11 3 2 1 2 F dxz 2.565 4 0 0 65 402 29 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 0 0 66 403 29 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 0 0 67 404 29 1 Fe 14 4 1 0 1 T Ppz 9.649 4 0 0 68 405 29 1 Fe 15 4 1 1 1 T Ppx 9.649 4 0 0 69 406 30 1 Fe 1 4 0 0 1 F s 9.649 4 0 0 70 407 30 1 Fe 2 4 0 0 2 F s 6.885 4 0 0 71 408 30 1 Fe 3 3 2 -2 1 F dxy 6.632 4 0 0 72 409 30 1 Fe 4 3 2 -1 1 F dyz 6.632 4 0 0 73 410 30 1 Fe 5 3 2 0 1 F dz2 6.632 4 0 0 74 411 30 1 Fe 6 3 2 1 1 F dxz 6.632 4 0 0 75 412 30 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 0 0 76 413 30 1 Fe 8 3 2 -2 2 F dxy 2.565 4 0 0 77 414 30 1 Fe 9 3 2 -1 2 F dyz 2.565 4 0 0 78 415 30 1 Fe 10 3 2 0 2 F dz2 2.565 4 0 0 79 416 30 1 Fe 11 3 2 1 2 F dxz 2.565 4 0 0 80 417 30 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 0 0 81 418 30 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 0 0 82 419 30 1 Fe 14 4 1 0 1 T Ppz 9.649 4 0 0 83 420 30 1 Fe 15 4 1 1 1 T Ppx 9.649 4 0 0 84 421 31 3 Te 1 5 0 0 1 F s 6.195 -4 0 0 1 422 31 3 Te 2 5 0 0 2 F s 4.205 -4 0 0 2 423 31 3 Te 3 5 1 -1 1 F py 8.156 -4 0 0 3 424 31 3 Te 4 5 1 0 1 F pz 8.156 -4 0 0 4 425 31 3 Te 5 5 1 1 1 F px 8.156 -4 0 0 5 426 31 3 Te 6 5 1 -1 2 F py 5.009 -4 0 0 6 427 31 3 Te 7 5 1 0 2 F pz 5.009 -4 0 0 7 428 31 3 Te 8 5 1 1 2 F px 5.009 -4 0 0 8 429 31 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 0 0 9 430 31 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 0 0 10 431 31 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 0 0 11 432 31 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 0 0 12 433 31 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 0 0 13 434 32 3 Te 1 5 0 0 1 F s 6.195 -4 0 0 14 435 32 3 Te 2 5 0 0 2 F s 4.205 -4 0 0 15 436 32 3 Te 3 5 1 -1 1 F py 8.156 -4 0 0 16 437 32 3 Te 4 5 1 0 1 F pz 8.156 -4 0 0 17 438 32 3 Te 5 5 1 1 1 F px 8.156 -4 0 0 18 439 32 3 Te 6 5 1 -1 2 F py 5.009 -4 0 0 19 440 32 3 Te 7 5 1 0 2 F pz 5.009 -4 0 0 20 441 32 3 Te 8 5 1 1 2 F px 5.009 -4 0 0 21 442 32 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 0 0 22 443 32 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 0 0 23 444 32 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 0 0 24 445 32 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 0 0 25 446 32 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 0 0 26 447 33 2 Ge 1 4 0 0 1 F s 6.581 -4 0 0 27 448 33 2 Ge 2 4 0 0 2 F s 4.412 -4 0 0 28 449 33 2 Ge 3 4 1 -1 1 F py 9.340 -4 0 0 29 450 33 2 Ge 4 4 1 0 1 F pz 9.340 -4 0 0 30 451 33 2 Ge 5 4 1 1 1 F px 9.340 -4 0 0 31 452 33 2 Ge 6 4 1 -1 2 F py 5.665 -4 0 0 32 453 33 2 Ge 7 4 1 0 2 F pz 5.665 -4 0 0 33 454 33 2 Ge 8 4 1 1 2 F px 5.665 -4 0 0 34 455 33 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 0 0 35 456 33 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 0 0 36 457 33 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 0 0 37 458 33 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 0 0 38 459 33 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 0 0 39 460 34 1 Fe 1 4 0 0 1 F s 9.649 -4 0 0 40 461 34 1 Fe 2 4 0 0 2 F s 6.885 -4 0 0 41 462 34 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 0 0 42 463 34 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 0 0 43 464 34 1 Fe 5 3 2 0 1 F dz2 6.632 -4 0 0 44 465 34 1 Fe 6 3 2 1 1 F dxz 6.632 -4 0 0 45 466 34 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 0 0 46 467 34 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 0 0 47 468 34 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 0 0 48 469 34 1 Fe 10 3 2 0 2 F dz2 2.565 -4 0 0 49 470 34 1 Fe 11 3 2 1 2 F dxz 2.565 -4 0 0 50 471 34 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 0 0 51 472 34 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 0 0 52 473 34 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 0 0 53 474 34 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 0 0 54 475 35 1 Fe 1 4 0 0 1 F s 9.649 -4 0 0 55 476 35 1 Fe 2 4 0 0 2 F s 6.885 -4 0 0 56 477 35 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 0 0 57 478 35 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 0 0 58 479 35 1 Fe 5 3 2 0 1 F dz2 6.632 -4 0 0 59 480 35 1 Fe 6 3 2 1 1 F dxz 6.632 -4 0 0 60 481 35 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 0 0 61 482 35 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 0 0 62 483 35 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 0 0 63 484 35 1 Fe 10 3 2 0 2 F dz2 2.565 -4 0 0 64 485 35 1 Fe 11 3 2 1 2 F dxz 2.565 -4 0 0 65 486 35 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 0 0 66 487 35 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 0 0 67 488 35 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 0 0 68 489 35 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 0 0 69 490 36 1 Fe 1 4 0 0 1 F s 9.649 -4 0 0 70 491 36 1 Fe 2 4 0 0 2 F s 6.885 -4 0 0 71 492 36 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 0 0 72 493 36 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 0 0 73 494 36 1 Fe 5 3 2 0 1 F dz2 6.632 -4 0 0 74 495 36 1 Fe 6 3 2 1 1 F dxz 6.632 -4 0 0 75 496 36 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 0 0 76 497 36 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 0 0 77 498 36 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 0 0 78 499 36 1 Fe 10 3 2 0 2 F dz2 2.565 -4 0 0 79 500 36 1 Fe 11 3 2 1 2 F dxz 2.565 -4 0 0 80 501 36 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 0 0 81 502 36 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 0 0 82 503 36 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 0 0 83 504 36 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 0 0 84 505 37 3 Te 1 5 0 0 1 F s 6.195 -3 0 0 1 506 37 3 Te 2 5 0 0 2 F s 4.205 -3 0 0 2 507 37 3 Te 3 5 1 -1 1 F py 8.156 -3 0 0 3 508 37 3 Te 4 5 1 0 1 F pz 8.156 -3 0 0 4 509 37 3 Te 5 5 1 1 1 F px 8.156 -3 0 0 5 510 37 3 Te 6 5 1 -1 2 F py 5.009 -3 0 0 6 511 37 3 Te 7 5 1 0 2 F pz 5.009 -3 0 0 7 512 37 3 Te 8 5 1 1 2 F px 5.009 -3 0 0 8 513 37 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 0 0 9 514 37 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 0 0 10 515 37 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 0 0 11 516 37 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 0 0 12 517 37 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 0 0 13 518 38 3 Te 1 5 0 0 1 F s 6.195 -3 0 0 14 519 38 3 Te 2 5 0 0 2 F s 4.205 -3 0 0 15 520 38 3 Te 3 5 1 -1 1 F py 8.156 -3 0 0 16 521 38 3 Te 4 5 1 0 1 F pz 8.156 -3 0 0 17 522 38 3 Te 5 5 1 1 1 F px 8.156 -3 0 0 18 523 38 3 Te 6 5 1 -1 2 F py 5.009 -3 0 0 19 524 38 3 Te 7 5 1 0 2 F pz 5.009 -3 0 0 20 525 38 3 Te 8 5 1 1 2 F px 5.009 -3 0 0 21 526 38 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 0 0 22 527 38 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 0 0 23 528 38 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 0 0 24 529 38 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 0 0 25 530 38 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 0 0 26 531 39 2 Ge 1 4 0 0 1 F s 6.581 -3 0 0 27 532 39 2 Ge 2 4 0 0 2 F s 4.412 -3 0 0 28 533 39 2 Ge 3 4 1 -1 1 F py 9.340 -3 0 0 29 534 39 2 Ge 4 4 1 0 1 F pz 9.340 -3 0 0 30 535 39 2 Ge 5 4 1 1 1 F px 9.340 -3 0 0 31 536 39 2 Ge 6 4 1 -1 2 F py 5.665 -3 0 0 32 537 39 2 Ge 7 4 1 0 2 F pz 5.665 -3 0 0 33 538 39 2 Ge 8 4 1 1 2 F px 5.665 -3 0 0 34 539 39 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 0 0 35 540 39 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 0 0 36 541 39 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 0 0 37 542 39 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 0 0 38 543 39 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 0 0 39 544 40 1 Fe 1 4 0 0 1 F s 9.649 -3 0 0 40 545 40 1 Fe 2 4 0 0 2 F s 6.885 -3 0 0 41 546 40 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 0 0 42 547 40 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 0 0 43 548 40 1 Fe 5 3 2 0 1 F dz2 6.632 -3 0 0 44 549 40 1 Fe 6 3 2 1 1 F dxz 6.632 -3 0 0 45 550 40 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 0 0 46 551 40 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 0 0 47 552 40 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 0 0 48 553 40 1 Fe 10 3 2 0 2 F dz2 2.565 -3 0 0 49 554 40 1 Fe 11 3 2 1 2 F dxz 2.565 -3 0 0 50 555 40 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 0 0 51 556 40 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 0 0 52 557 40 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 0 0 53 558 40 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 0 0 54 559 41 1 Fe 1 4 0 0 1 F s 9.649 -3 0 0 55 560 41 1 Fe 2 4 0 0 2 F s 6.885 -3 0 0 56 561 41 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 0 0 57 562 41 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 0 0 58 563 41 1 Fe 5 3 2 0 1 F dz2 6.632 -3 0 0 59 564 41 1 Fe 6 3 2 1 1 F dxz 6.632 -3 0 0 60 565 41 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 0 0 61 566 41 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 0 0 62 567 41 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 0 0 63 568 41 1 Fe 10 3 2 0 2 F dz2 2.565 -3 0 0 64 569 41 1 Fe 11 3 2 1 2 F dxz 2.565 -3 0 0 65 570 41 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 0 0 66 571 41 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 0 0 67 572 41 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 0 0 68 573 41 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 0 0 69 574 42 1 Fe 1 4 0 0 1 F s 9.649 -3 0 0 70 575 42 1 Fe 2 4 0 0 2 F s 6.885 -3 0 0 71 576 42 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 0 0 72 577 42 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 0 0 73 578 42 1 Fe 5 3 2 0 1 F dz2 6.632 -3 0 0 74 579 42 1 Fe 6 3 2 1 1 F dxz 6.632 -3 0 0 75 580 42 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 0 0 76 581 42 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 0 0 77 582 42 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 0 0 78 583 42 1 Fe 10 3 2 0 2 F dz2 2.565 -3 0 0 79 584 42 1 Fe 11 3 2 1 2 F dxz 2.565 -3 0 0 80 585 42 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 0 0 81 586 42 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 0 0 82 587 42 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 0 0 83 588 42 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 0 0 84 589 43 3 Te 1 5 0 0 1 F s 6.195 -2 0 0 1 590 43 3 Te 2 5 0 0 2 F s 4.205 -2 0 0 2 591 43 3 Te 3 5 1 -1 1 F py 8.156 -2 0 0 3 592 43 3 Te 4 5 1 0 1 F pz 8.156 -2 0 0 4 593 43 3 Te 5 5 1 1 1 F px 8.156 -2 0 0 5 594 43 3 Te 6 5 1 -1 2 F py 5.009 -2 0 0 6 595 43 3 Te 7 5 1 0 2 F pz 5.009 -2 0 0 7 596 43 3 Te 8 5 1 1 2 F px 5.009 -2 0 0 8 597 43 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 0 0 9 598 43 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 0 0 10 599 43 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 0 0 11 600 43 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 0 0 12 601 43 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 0 0 13 602 44 3 Te 1 5 0 0 1 F s 6.195 -2 0 0 14 603 44 3 Te 2 5 0 0 2 F s 4.205 -2 0 0 15 604 44 3 Te 3 5 1 -1 1 F py 8.156 -2 0 0 16 605 44 3 Te 4 5 1 0 1 F pz 8.156 -2 0 0 17 606 44 3 Te 5 5 1 1 1 F px 8.156 -2 0 0 18 607 44 3 Te 6 5 1 -1 2 F py 5.009 -2 0 0 19 608 44 3 Te 7 5 1 0 2 F pz 5.009 -2 0 0 20 609 44 3 Te 8 5 1 1 2 F px 5.009 -2 0 0 21 610 44 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 0 0 22 611 44 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 0 0 23 612 44 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 0 0 24 613 44 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 0 0 25 614 44 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 0 0 26 615 45 2 Ge 1 4 0 0 1 F s 6.581 -2 0 0 27 616 45 2 Ge 2 4 0 0 2 F s 4.412 -2 0 0 28 617 45 2 Ge 3 4 1 -1 1 F py 9.340 -2 0 0 29 618 45 2 Ge 4 4 1 0 1 F pz 9.340 -2 0 0 30 619 45 2 Ge 5 4 1 1 1 F px 9.340 -2 0 0 31 620 45 2 Ge 6 4 1 -1 2 F py 5.665 -2 0 0 32 621 45 2 Ge 7 4 1 0 2 F pz 5.665 -2 0 0 33 622 45 2 Ge 8 4 1 1 2 F px 5.665 -2 0 0 34 623 45 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 0 0 35 624 45 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 0 0 36 625 45 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 0 0 37 626 45 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 0 0 38 627 45 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 0 0 39 628 46 1 Fe 1 4 0 0 1 F s 9.649 -2 0 0 40 629 46 1 Fe 2 4 0 0 2 F s 6.885 -2 0 0 41 630 46 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 0 0 42 631 46 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 0 0 43 632 46 1 Fe 5 3 2 0 1 F dz2 6.632 -2 0 0 44 633 46 1 Fe 6 3 2 1 1 F dxz 6.632 -2 0 0 45 634 46 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 0 0 46 635 46 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 0 0 47 636 46 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 0 0 48 637 46 1 Fe 10 3 2 0 2 F dz2 2.565 -2 0 0 49 638 46 1 Fe 11 3 2 1 2 F dxz 2.565 -2 0 0 50 639 46 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 0 0 51 640 46 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 0 0 52 641 46 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 0 0 53 642 46 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 0 0 54 643 47 1 Fe 1 4 0 0 1 F s 9.649 -2 0 0 55 644 47 1 Fe 2 4 0 0 2 F s 6.885 -2 0 0 56 645 47 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 0 0 57 646 47 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 0 0 58 647 47 1 Fe 5 3 2 0 1 F dz2 6.632 -2 0 0 59 648 47 1 Fe 6 3 2 1 1 F dxz 6.632 -2 0 0 60 649 47 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 0 0 61 650 47 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 0 0 62 651 47 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 0 0 63 652 47 1 Fe 10 3 2 0 2 F dz2 2.565 -2 0 0 64 653 47 1 Fe 11 3 2 1 2 F dxz 2.565 -2 0 0 65 654 47 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 0 0 66 655 47 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 0 0 67 656 47 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 0 0 68 657 47 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 0 0 69 658 48 1 Fe 1 4 0 0 1 F s 9.649 -2 0 0 70 659 48 1 Fe 2 4 0 0 2 F s 6.885 -2 0 0 71 660 48 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 0 0 72 661 48 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 0 0 73 662 48 1 Fe 5 3 2 0 1 F dz2 6.632 -2 0 0 74 663 48 1 Fe 6 3 2 1 1 F dxz 6.632 -2 0 0 75 664 48 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 0 0 76 665 48 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 0 0 77 666 48 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 0 0 78 667 48 1 Fe 10 3 2 0 2 F dz2 2.565 -2 0 0 79 668 48 1 Fe 11 3 2 1 2 F dxz 2.565 -2 0 0 80 669 48 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 0 0 81 670 48 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 0 0 82 671 48 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 0 0 83 672 48 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 0 0 84 673 49 3 Te 1 5 0 0 1 F s 6.195 -1 0 0 1 674 49 3 Te 2 5 0 0 2 F s 4.205 -1 0 0 2 675 49 3 Te 3 5 1 -1 1 F py 8.156 -1 0 0 3 676 49 3 Te 4 5 1 0 1 F pz 8.156 -1 0 0 4 677 49 3 Te 5 5 1 1 1 F px 8.156 -1 0 0 5 678 49 3 Te 6 5 1 -1 2 F py 5.009 -1 0 0 6 679 49 3 Te 7 5 1 0 2 F pz 5.009 -1 0 0 7 680 49 3 Te 8 5 1 1 2 F px 5.009 -1 0 0 8 681 49 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 0 0 9 682 49 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 0 0 10 683 49 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 0 0 11 684 49 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 0 0 12 685 49 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 0 0 13 686 50 3 Te 1 5 0 0 1 F s 6.195 -1 0 0 14 687 50 3 Te 2 5 0 0 2 F s 4.205 -1 0 0 15 688 50 3 Te 3 5 1 -1 1 F py 8.156 -1 0 0 16 689 50 3 Te 4 5 1 0 1 F pz 8.156 -1 0 0 17 690 50 3 Te 5 5 1 1 1 F px 8.156 -1 0 0 18 691 50 3 Te 6 5 1 -1 2 F py 5.009 -1 0 0 19 692 50 3 Te 7 5 1 0 2 F pz 5.009 -1 0 0 20 693 50 3 Te 8 5 1 1 2 F px 5.009 -1 0 0 21 694 50 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 0 0 22 695 50 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 0 0 23 696 50 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 0 0 24 697 50 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 0 0 25 698 50 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 0 0 26 699 51 2 Ge 1 4 0 0 1 F s 6.581 -1 0 0 27 700 51 2 Ge 2 4 0 0 2 F s 4.412 -1 0 0 28 701 51 2 Ge 3 4 1 -1 1 F py 9.340 -1 0 0 29 702 51 2 Ge 4 4 1 0 1 F pz 9.340 -1 0 0 30 703 51 2 Ge 5 4 1 1 1 F px 9.340 -1 0 0 31 704 51 2 Ge 6 4 1 -1 2 F py 5.665 -1 0 0 32 705 51 2 Ge 7 4 1 0 2 F pz 5.665 -1 0 0 33 706 51 2 Ge 8 4 1 1 2 F px 5.665 -1 0 0 34 707 51 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 0 0 35 708 51 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 0 0 36 709 51 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 0 0 37 710 51 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 0 0 38 711 51 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 0 0 39 712 52 1 Fe 1 4 0 0 1 F s 9.649 -1 0 0 40 713 52 1 Fe 2 4 0 0 2 F s 6.885 -1 0 0 41 714 52 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 0 0 42 715 52 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 0 0 43 716 52 1 Fe 5 3 2 0 1 F dz2 6.632 -1 0 0 44 717 52 1 Fe 6 3 2 1 1 F dxz 6.632 -1 0 0 45 718 52 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 0 0 46 719 52 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 0 0 47 720 52 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 0 0 48 721 52 1 Fe 10 3 2 0 2 F dz2 2.565 -1 0 0 49 722 52 1 Fe 11 3 2 1 2 F dxz 2.565 -1 0 0 50 723 52 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 0 0 51 724 52 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 0 0 52 725 52 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 0 0 53 726 52 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 0 0 54 727 53 1 Fe 1 4 0 0 1 F s 9.649 -1 0 0 55 728 53 1 Fe 2 4 0 0 2 F s 6.885 -1 0 0 56 729 53 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 0 0 57 730 53 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 0 0 58 731 53 1 Fe 5 3 2 0 1 F dz2 6.632 -1 0 0 59 732 53 1 Fe 6 3 2 1 1 F dxz 6.632 -1 0 0 60 733 53 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 0 0 61 734 53 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 0 0 62 735 53 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 0 0 63 736 53 1 Fe 10 3 2 0 2 F dz2 2.565 -1 0 0 64 737 53 1 Fe 11 3 2 1 2 F dxz 2.565 -1 0 0 65 738 53 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 0 0 66 739 53 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 0 0 67 740 53 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 0 0 68 741 53 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 0 0 69 742 54 1 Fe 1 4 0 0 1 F s 9.649 -1 0 0 70 743 54 1 Fe 2 4 0 0 2 F s 6.885 -1 0 0 71 744 54 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 0 0 72 745 54 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 0 0 73 746 54 1 Fe 5 3 2 0 1 F dz2 6.632 -1 0 0 74 747 54 1 Fe 6 3 2 1 1 F dxz 6.632 -1 0 0 75 748 54 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 0 0 76 749 54 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 0 0 77 750 54 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 0 0 78 751 54 1 Fe 10 3 2 0 2 F dz2 2.565 -1 0 0 79 752 54 1 Fe 11 3 2 1 2 F dxz 2.565 -1 0 0 80 753 54 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 0 0 81 754 54 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 0 0 82 755 54 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 0 0 83 756 54 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 0 0 84 757 55 3 Te 1 5 0 0 1 F s 6.195 0 1 0 1 758 55 3 Te 2 5 0 0 2 F s 4.205 0 1 0 2 759 55 3 Te 3 5 1 -1 1 F py 8.156 0 1 0 3 760 55 3 Te 4 5 1 0 1 F pz 8.156 0 1 0 4 761 55 3 Te 5 5 1 1 1 F px 8.156 0 1 0 5 762 55 3 Te 6 5 1 -1 2 F py 5.009 0 1 0 6 763 55 3 Te 7 5 1 0 2 F pz 5.009 0 1 0 7 764 55 3 Te 8 5 1 1 2 F px 5.009 0 1 0 8 765 55 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 1 0 9 766 55 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 1 0 10 767 55 3 Te 11 5 2 0 1 T Pdz2 8.156 0 1 0 11 768 55 3 Te 12 5 2 1 1 T Pdxz 8.156 0 1 0 12 769 55 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 1 0 13 770 56 3 Te 1 5 0 0 1 F s 6.195 0 1 0 14 771 56 3 Te 2 5 0 0 2 F s 4.205 0 1 0 15 772 56 3 Te 3 5 1 -1 1 F py 8.156 0 1 0 16 773 56 3 Te 4 5 1 0 1 F pz 8.156 0 1 0 17 774 56 3 Te 5 5 1 1 1 F px 8.156 0 1 0 18 775 56 3 Te 6 5 1 -1 2 F py 5.009 0 1 0 19 776 56 3 Te 7 5 1 0 2 F pz 5.009 0 1 0 20 777 56 3 Te 8 5 1 1 2 F px 5.009 0 1 0 21 778 56 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 1 0 22 779 56 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 1 0 23 780 56 3 Te 11 5 2 0 1 T Pdz2 8.156 0 1 0 24 781 56 3 Te 12 5 2 1 1 T Pdxz 8.156 0 1 0 25 782 56 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 1 0 26 783 57 2 Ge 1 4 0 0 1 F s 6.581 0 1 0 27 784 57 2 Ge 2 4 0 0 2 F s 4.412 0 1 0 28 785 57 2 Ge 3 4 1 -1 1 F py 9.340 0 1 0 29 786 57 2 Ge 4 4 1 0 1 F pz 9.340 0 1 0 30 787 57 2 Ge 5 4 1 1 1 F px 9.340 0 1 0 31 788 57 2 Ge 6 4 1 -1 2 F py 5.665 0 1 0 32 789 57 2 Ge 7 4 1 0 2 F pz 5.665 0 1 0 33 790 57 2 Ge 8 4 1 1 2 F px 5.665 0 1 0 34 791 57 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 1 0 35 792 57 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 1 0 36 793 57 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 1 0 37 794 57 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 1 0 38 795 57 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 1 0 39 796 58 1 Fe 1 4 0 0 1 F s 9.649 0 1 0 40 797 58 1 Fe 2 4 0 0 2 F s 6.885 0 1 0 41 798 58 1 Fe 3 3 2 -2 1 F dxy 6.632 0 1 0 42 799 58 1 Fe 4 3 2 -1 1 F dyz 6.632 0 1 0 43 800 58 1 Fe 5 3 2 0 1 F dz2 6.632 0 1 0 44 801 58 1 Fe 6 3 2 1 1 F dxz 6.632 0 1 0 45 802 58 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 1 0 46 803 58 1 Fe 8 3 2 -2 2 F dxy 2.565 0 1 0 47 804 58 1 Fe 9 3 2 -1 2 F dyz 2.565 0 1 0 48 805 58 1 Fe 10 3 2 0 2 F dz2 2.565 0 1 0 49 806 58 1 Fe 11 3 2 1 2 F dxz 2.565 0 1 0 50 807 58 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 1 0 51 808 58 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 1 0 52 809 58 1 Fe 14 4 1 0 1 T Ppz 9.649 0 1 0 53 810 58 1 Fe 15 4 1 1 1 T Ppx 9.649 0 1 0 54 811 59 1 Fe 1 4 0 0 1 F s 9.649 0 1 0 55 812 59 1 Fe 2 4 0 0 2 F s 6.885 0 1 0 56 813 59 1 Fe 3 3 2 -2 1 F dxy 6.632 0 1 0 57 814 59 1 Fe 4 3 2 -1 1 F dyz 6.632 0 1 0 58 815 59 1 Fe 5 3 2 0 1 F dz2 6.632 0 1 0 59 816 59 1 Fe 6 3 2 1 1 F dxz 6.632 0 1 0 60 817 59 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 1 0 61 818 59 1 Fe 8 3 2 -2 2 F dxy 2.565 0 1 0 62 819 59 1 Fe 9 3 2 -1 2 F dyz 2.565 0 1 0 63 820 59 1 Fe 10 3 2 0 2 F dz2 2.565 0 1 0 64 821 59 1 Fe 11 3 2 1 2 F dxz 2.565 0 1 0 65 822 59 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 1 0 66 823 59 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 1 0 67 824 59 1 Fe 14 4 1 0 1 T Ppz 9.649 0 1 0 68 825 59 1 Fe 15 4 1 1 1 T Ppx 9.649 0 1 0 69 826 60 1 Fe 1 4 0 0 1 F s 9.649 0 1 0 70 827 60 1 Fe 2 4 0 0 2 F s 6.885 0 1 0 71 828 60 1 Fe 3 3 2 -2 1 F dxy 6.632 0 1 0 72 829 60 1 Fe 4 3 2 -1 1 F dyz 6.632 0 1 0 73 830 60 1 Fe 5 3 2 0 1 F dz2 6.632 0 1 0 74 831 60 1 Fe 6 3 2 1 1 F dxz 6.632 0 1 0 75 832 60 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 1 0 76 833 60 1 Fe 8 3 2 -2 2 F dxy 2.565 0 1 0 77 834 60 1 Fe 9 3 2 -1 2 F dyz 2.565 0 1 0 78 835 60 1 Fe 10 3 2 0 2 F dz2 2.565 0 1 0 79 836 60 1 Fe 11 3 2 1 2 F dxz 2.565 0 1 0 80 837 60 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 1 0 81 838 60 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 1 0 82 839 60 1 Fe 14 4 1 0 1 T Ppz 9.649 0 1 0 83 840 60 1 Fe 15 4 1 1 1 T Ppx 9.649 0 1 0 84 841 61 3 Te 1 5 0 0 1 F s 6.195 1 1 0 1 842 61 3 Te 2 5 0 0 2 F s 4.205 1 1 0 2 843 61 3 Te 3 5 1 -1 1 F py 8.156 1 1 0 3 844 61 3 Te 4 5 1 0 1 F pz 8.156 1 1 0 4 845 61 3 Te 5 5 1 1 1 F px 8.156 1 1 0 5 846 61 3 Te 6 5 1 -1 2 F py 5.009 1 1 0 6 847 61 3 Te 7 5 1 0 2 F pz 5.009 1 1 0 7 848 61 3 Te 8 5 1 1 2 F px 5.009 1 1 0 8 849 61 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 1 0 9 850 61 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 1 0 10 851 61 3 Te 11 5 2 0 1 T Pdz2 8.156 1 1 0 11 852 61 3 Te 12 5 2 1 1 T Pdxz 8.156 1 1 0 12 853 61 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 1 0 13 854 62 3 Te 1 5 0 0 1 F s 6.195 1 1 0 14 855 62 3 Te 2 5 0 0 2 F s 4.205 1 1 0 15 856 62 3 Te 3 5 1 -1 1 F py 8.156 1 1 0 16 857 62 3 Te 4 5 1 0 1 F pz 8.156 1 1 0 17 858 62 3 Te 5 5 1 1 1 F px 8.156 1 1 0 18 859 62 3 Te 6 5 1 -1 2 F py 5.009 1 1 0 19 860 62 3 Te 7 5 1 0 2 F pz 5.009 1 1 0 20 861 62 3 Te 8 5 1 1 2 F px 5.009 1 1 0 21 862 62 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 1 0 22 863 62 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 1 0 23 864 62 3 Te 11 5 2 0 1 T Pdz2 8.156 1 1 0 24 865 62 3 Te 12 5 2 1 1 T Pdxz 8.156 1 1 0 25 866 62 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 1 0 26 867 63 2 Ge 1 4 0 0 1 F s 6.581 1 1 0 27 868 63 2 Ge 2 4 0 0 2 F s 4.412 1 1 0 28 869 63 2 Ge 3 4 1 -1 1 F py 9.340 1 1 0 29 870 63 2 Ge 4 4 1 0 1 F pz 9.340 1 1 0 30 871 63 2 Ge 5 4 1 1 1 F px 9.340 1 1 0 31 872 63 2 Ge 6 4 1 -1 2 F py 5.665 1 1 0 32 873 63 2 Ge 7 4 1 0 2 F pz 5.665 1 1 0 33 874 63 2 Ge 8 4 1 1 2 F px 5.665 1 1 0 34 875 63 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 1 0 35 876 63 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 1 0 36 877 63 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 1 0 37 878 63 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 1 0 38 879 63 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 1 0 39 880 64 1 Fe 1 4 0 0 1 F s 9.649 1 1 0 40 881 64 1 Fe 2 4 0 0 2 F s 6.885 1 1 0 41 882 64 1 Fe 3 3 2 -2 1 F dxy 6.632 1 1 0 42 883 64 1 Fe 4 3 2 -1 1 F dyz 6.632 1 1 0 43 884 64 1 Fe 5 3 2 0 1 F dz2 6.632 1 1 0 44 885 64 1 Fe 6 3 2 1 1 F dxz 6.632 1 1 0 45 886 64 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 1 0 46 887 64 1 Fe 8 3 2 -2 2 F dxy 2.565 1 1 0 47 888 64 1 Fe 9 3 2 -1 2 F dyz 2.565 1 1 0 48 889 64 1 Fe 10 3 2 0 2 F dz2 2.565 1 1 0 49 890 64 1 Fe 11 3 2 1 2 F dxz 2.565 1 1 0 50 891 64 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 1 0 51 892 64 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 1 0 52 893 64 1 Fe 14 4 1 0 1 T Ppz 9.649 1 1 0 53 894 64 1 Fe 15 4 1 1 1 T Ppx 9.649 1 1 0 54 895 65 1 Fe 1 4 0 0 1 F s 9.649 1 1 0 55 896 65 1 Fe 2 4 0 0 2 F s 6.885 1 1 0 56 897 65 1 Fe 3 3 2 -2 1 F dxy 6.632 1 1 0 57 898 65 1 Fe 4 3 2 -1 1 F dyz 6.632 1 1 0 58 899 65 1 Fe 5 3 2 0 1 F dz2 6.632 1 1 0 59 900 65 1 Fe 6 3 2 1 1 F dxz 6.632 1 1 0 60 901 65 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 1 0 61 902 65 1 Fe 8 3 2 -2 2 F dxy 2.565 1 1 0 62 903 65 1 Fe 9 3 2 -1 2 F dyz 2.565 1 1 0 63 904 65 1 Fe 10 3 2 0 2 F dz2 2.565 1 1 0 64 905 65 1 Fe 11 3 2 1 2 F dxz 2.565 1 1 0 65 906 65 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 1 0 66 907 65 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 1 0 67 908 65 1 Fe 14 4 1 0 1 T Ppz 9.649 1 1 0 68 909 65 1 Fe 15 4 1 1 1 T Ppx 9.649 1 1 0 69 910 66 1 Fe 1 4 0 0 1 F s 9.649 1 1 0 70 911 66 1 Fe 2 4 0 0 2 F s 6.885 1 1 0 71 912 66 1 Fe 3 3 2 -2 1 F dxy 6.632 1 1 0 72 913 66 1 Fe 4 3 2 -1 1 F dyz 6.632 1 1 0 73 914 66 1 Fe 5 3 2 0 1 F dz2 6.632 1 1 0 74 915 66 1 Fe 6 3 2 1 1 F dxz 6.632 1 1 0 75 916 66 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 1 0 76 917 66 1 Fe 8 3 2 -2 2 F dxy 2.565 1 1 0 77 918 66 1 Fe 9 3 2 -1 2 F dyz 2.565 1 1 0 78 919 66 1 Fe 10 3 2 0 2 F dz2 2.565 1 1 0 79 920 66 1 Fe 11 3 2 1 2 F dxz 2.565 1 1 0 80 921 66 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 1 0 81 922 66 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 1 0 82 923 66 1 Fe 14 4 1 0 1 T Ppz 9.649 1 1 0 83 924 66 1 Fe 15 4 1 1 1 T Ppx 9.649 1 1 0 84 925 67 3 Te 1 5 0 0 1 F s 6.195 2 1 0 1 926 67 3 Te 2 5 0 0 2 F s 4.205 2 1 0 2 927 67 3 Te 3 5 1 -1 1 F py 8.156 2 1 0 3 928 67 3 Te 4 5 1 0 1 F pz 8.156 2 1 0 4 929 67 3 Te 5 5 1 1 1 F px 8.156 2 1 0 5 930 67 3 Te 6 5 1 -1 2 F py 5.009 2 1 0 6 931 67 3 Te 7 5 1 0 2 F pz 5.009 2 1 0 7 932 67 3 Te 8 5 1 1 2 F px 5.009 2 1 0 8 933 67 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 1 0 9 934 67 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 1 0 10 935 67 3 Te 11 5 2 0 1 T Pdz2 8.156 2 1 0 11 936 67 3 Te 12 5 2 1 1 T Pdxz 8.156 2 1 0 12 937 67 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 1 0 13 938 68 3 Te 1 5 0 0 1 F s 6.195 2 1 0 14 939 68 3 Te 2 5 0 0 2 F s 4.205 2 1 0 15 940 68 3 Te 3 5 1 -1 1 F py 8.156 2 1 0 16 941 68 3 Te 4 5 1 0 1 F pz 8.156 2 1 0 17 942 68 3 Te 5 5 1 1 1 F px 8.156 2 1 0 18 943 68 3 Te 6 5 1 -1 2 F py 5.009 2 1 0 19 944 68 3 Te 7 5 1 0 2 F pz 5.009 2 1 0 20 945 68 3 Te 8 5 1 1 2 F px 5.009 2 1 0 21 946 68 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 1 0 22 947 68 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 1 0 23 948 68 3 Te 11 5 2 0 1 T Pdz2 8.156 2 1 0 24 949 68 3 Te 12 5 2 1 1 T Pdxz 8.156 2 1 0 25 950 68 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 1 0 26 951 69 2 Ge 1 4 0 0 1 F s 6.581 2 1 0 27 952 69 2 Ge 2 4 0 0 2 F s 4.412 2 1 0 28 953 69 2 Ge 3 4 1 -1 1 F py 9.340 2 1 0 29 954 69 2 Ge 4 4 1 0 1 F pz 9.340 2 1 0 30 955 69 2 Ge 5 4 1 1 1 F px 9.340 2 1 0 31 956 69 2 Ge 6 4 1 -1 2 F py 5.665 2 1 0 32 957 69 2 Ge 7 4 1 0 2 F pz 5.665 2 1 0 33 958 69 2 Ge 8 4 1 1 2 F px 5.665 2 1 0 34 959 69 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 1 0 35 960 69 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 1 0 36 961 69 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 1 0 37 962 69 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 1 0 38 963 69 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 1 0 39 964 70 1 Fe 1 4 0 0 1 F s 9.649 2 1 0 40 965 70 1 Fe 2 4 0 0 2 F s 6.885 2 1 0 41 966 70 1 Fe 3 3 2 -2 1 F dxy 6.632 2 1 0 42 967 70 1 Fe 4 3 2 -1 1 F dyz 6.632 2 1 0 43 968 70 1 Fe 5 3 2 0 1 F dz2 6.632 2 1 0 44 969 70 1 Fe 6 3 2 1 1 F dxz 6.632 2 1 0 45 970 70 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 1 0 46 971 70 1 Fe 8 3 2 -2 2 F dxy 2.565 2 1 0 47 972 70 1 Fe 9 3 2 -1 2 F dyz 2.565 2 1 0 48 973 70 1 Fe 10 3 2 0 2 F dz2 2.565 2 1 0 49 974 70 1 Fe 11 3 2 1 2 F dxz 2.565 2 1 0 50 975 70 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 1 0 51 976 70 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 1 0 52 977 70 1 Fe 14 4 1 0 1 T Ppz 9.649 2 1 0 53 978 70 1 Fe 15 4 1 1 1 T Ppx 9.649 2 1 0 54 979 71 1 Fe 1 4 0 0 1 F s 9.649 2 1 0 55 980 71 1 Fe 2 4 0 0 2 F s 6.885 2 1 0 56 981 71 1 Fe 3 3 2 -2 1 F dxy 6.632 2 1 0 57 982 71 1 Fe 4 3 2 -1 1 F dyz 6.632 2 1 0 58 983 71 1 Fe 5 3 2 0 1 F dz2 6.632 2 1 0 59 984 71 1 Fe 6 3 2 1 1 F dxz 6.632 2 1 0 60 985 71 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 1 0 61 986 71 1 Fe 8 3 2 -2 2 F dxy 2.565 2 1 0 62 987 71 1 Fe 9 3 2 -1 2 F dyz 2.565 2 1 0 63 988 71 1 Fe 10 3 2 0 2 F dz2 2.565 2 1 0 64 989 71 1 Fe 11 3 2 1 2 F dxz 2.565 2 1 0 65 990 71 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 1 0 66 991 71 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 1 0 67 992 71 1 Fe 14 4 1 0 1 T Ppz 9.649 2 1 0 68 993 71 1 Fe 15 4 1 1 1 T Ppx 9.649 2 1 0 69 994 72 1 Fe 1 4 0 0 1 F s 9.649 2 1 0 70 995 72 1 Fe 2 4 0 0 2 F s 6.885 2 1 0 71 996 72 1 Fe 3 3 2 -2 1 F dxy 6.632 2 1 0 72 997 72 1 Fe 4 3 2 -1 1 F dyz 6.632 2 1 0 73 998 72 1 Fe 5 3 2 0 1 F dz2 6.632 2 1 0 74 999 72 1 Fe 6 3 2 1 1 F dxz 6.632 2 1 0 75 1000 72 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 1 0 76 1001 72 1 Fe 8 3 2 -2 2 F dxy 2.565 2 1 0 77 1002 72 1 Fe 9 3 2 -1 2 F dyz 2.565 2 1 0 78 1003 72 1 Fe 10 3 2 0 2 F dz2 2.565 2 1 0 79 1004 72 1 Fe 11 3 2 1 2 F dxz 2.565 2 1 0 80 1005 72 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 1 0 81 1006 72 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 1 0 82 1007 72 1 Fe 14 4 1 0 1 T Ppz 9.649 2 1 0 83 1008 72 1 Fe 15 4 1 1 1 T Ppx 9.649 2 1 0 84 1009 73 3 Te 1 5 0 0 1 F s 6.195 3 1 0 1 1010 73 3 Te 2 5 0 0 2 F s 4.205 3 1 0 2 1011 73 3 Te 3 5 1 -1 1 F py 8.156 3 1 0 3 1012 73 3 Te 4 5 1 0 1 F pz 8.156 3 1 0 4 1013 73 3 Te 5 5 1 1 1 F px 8.156 3 1 0 5 1014 73 3 Te 6 5 1 -1 2 F py 5.009 3 1 0 6 1015 73 3 Te 7 5 1 0 2 F pz 5.009 3 1 0 7 1016 73 3 Te 8 5 1 1 2 F px 5.009 3 1 0 8 1017 73 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 1 0 9 1018 73 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 1 0 10 1019 73 3 Te 11 5 2 0 1 T Pdz2 8.156 3 1 0 11 1020 73 3 Te 12 5 2 1 1 T Pdxz 8.156 3 1 0 12 1021 73 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 1 0 13 1022 74 3 Te 1 5 0 0 1 F s 6.195 3 1 0 14 1023 74 3 Te 2 5 0 0 2 F s 4.205 3 1 0 15 1024 74 3 Te 3 5 1 -1 1 F py 8.156 3 1 0 16 1025 74 3 Te 4 5 1 0 1 F pz 8.156 3 1 0 17 1026 74 3 Te 5 5 1 1 1 F px 8.156 3 1 0 18 1027 74 3 Te 6 5 1 -1 2 F py 5.009 3 1 0 19 1028 74 3 Te 7 5 1 0 2 F pz 5.009 3 1 0 20 1029 74 3 Te 8 5 1 1 2 F px 5.009 3 1 0 21 1030 74 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 1 0 22 1031 74 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 1 0 23 1032 74 3 Te 11 5 2 0 1 T Pdz2 8.156 3 1 0 24 1033 74 3 Te 12 5 2 1 1 T Pdxz 8.156 3 1 0 25 1034 74 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 1 0 26 1035 75 2 Ge 1 4 0 0 1 F s 6.581 3 1 0 27 1036 75 2 Ge 2 4 0 0 2 F s 4.412 3 1 0 28 1037 75 2 Ge 3 4 1 -1 1 F py 9.340 3 1 0 29 1038 75 2 Ge 4 4 1 0 1 F pz 9.340 3 1 0 30 1039 75 2 Ge 5 4 1 1 1 F px 9.340 3 1 0 31 1040 75 2 Ge 6 4 1 -1 2 F py 5.665 3 1 0 32 1041 75 2 Ge 7 4 1 0 2 F pz 5.665 3 1 0 33 1042 75 2 Ge 8 4 1 1 2 F px 5.665 3 1 0 34 1043 75 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 1 0 35 1044 75 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 1 0 36 1045 75 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 1 0 37 1046 75 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 1 0 38 1047 75 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 1 0 39 1048 76 1 Fe 1 4 0 0 1 F s 9.649 3 1 0 40 1049 76 1 Fe 2 4 0 0 2 F s 6.885 3 1 0 41 1050 76 1 Fe 3 3 2 -2 1 F dxy 6.632 3 1 0 42 1051 76 1 Fe 4 3 2 -1 1 F dyz 6.632 3 1 0 43 1052 76 1 Fe 5 3 2 0 1 F dz2 6.632 3 1 0 44 1053 76 1 Fe 6 3 2 1 1 F dxz 6.632 3 1 0 45 1054 76 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 1 0 46 1055 76 1 Fe 8 3 2 -2 2 F dxy 2.565 3 1 0 47 1056 76 1 Fe 9 3 2 -1 2 F dyz 2.565 3 1 0 48 1057 76 1 Fe 10 3 2 0 2 F dz2 2.565 3 1 0 49 1058 76 1 Fe 11 3 2 1 2 F dxz 2.565 3 1 0 50 1059 76 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 1 0 51 1060 76 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 1 0 52 1061 76 1 Fe 14 4 1 0 1 T Ppz 9.649 3 1 0 53 1062 76 1 Fe 15 4 1 1 1 T Ppx 9.649 3 1 0 54 1063 77 1 Fe 1 4 0 0 1 F s 9.649 3 1 0 55 1064 77 1 Fe 2 4 0 0 2 F s 6.885 3 1 0 56 1065 77 1 Fe 3 3 2 -2 1 F dxy 6.632 3 1 0 57 1066 77 1 Fe 4 3 2 -1 1 F dyz 6.632 3 1 0 58 1067 77 1 Fe 5 3 2 0 1 F dz2 6.632 3 1 0 59 1068 77 1 Fe 6 3 2 1 1 F dxz 6.632 3 1 0 60 1069 77 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 1 0 61 1070 77 1 Fe 8 3 2 -2 2 F dxy 2.565 3 1 0 62 1071 77 1 Fe 9 3 2 -1 2 F dyz 2.565 3 1 0 63 1072 77 1 Fe 10 3 2 0 2 F dz2 2.565 3 1 0 64 1073 77 1 Fe 11 3 2 1 2 F dxz 2.565 3 1 0 65 1074 77 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 1 0 66 1075 77 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 1 0 67 1076 77 1 Fe 14 4 1 0 1 T Ppz 9.649 3 1 0 68 1077 77 1 Fe 15 4 1 1 1 T Ppx 9.649 3 1 0 69 1078 78 1 Fe 1 4 0 0 1 F s 9.649 3 1 0 70 1079 78 1 Fe 2 4 0 0 2 F s 6.885 3 1 0 71 1080 78 1 Fe 3 3 2 -2 1 F dxy 6.632 3 1 0 72 1081 78 1 Fe 4 3 2 -1 1 F dyz 6.632 3 1 0 73 1082 78 1 Fe 5 3 2 0 1 F dz2 6.632 3 1 0 74 1083 78 1 Fe 6 3 2 1 1 F dxz 6.632 3 1 0 75 1084 78 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 1 0 76 1085 78 1 Fe 8 3 2 -2 2 F dxy 2.565 3 1 0 77 1086 78 1 Fe 9 3 2 -1 2 F dyz 2.565 3 1 0 78 1087 78 1 Fe 10 3 2 0 2 F dz2 2.565 3 1 0 79 1088 78 1 Fe 11 3 2 1 2 F dxz 2.565 3 1 0 80 1089 78 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 1 0 81 1090 78 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 1 0 82 1091 78 1 Fe 14 4 1 0 1 T Ppz 9.649 3 1 0 83 1092 78 1 Fe 15 4 1 1 1 T Ppx 9.649 3 1 0 84 1093 79 3 Te 1 5 0 0 1 F s 6.195 4 1 0 1 1094 79 3 Te 2 5 0 0 2 F s 4.205 4 1 0 2 1095 79 3 Te 3 5 1 -1 1 F py 8.156 4 1 0 3 1096 79 3 Te 4 5 1 0 1 F pz 8.156 4 1 0 4 1097 79 3 Te 5 5 1 1 1 F px 8.156 4 1 0 5 1098 79 3 Te 6 5 1 -1 2 F py 5.009 4 1 0 6 1099 79 3 Te 7 5 1 0 2 F pz 5.009 4 1 0 7 1100 79 3 Te 8 5 1 1 2 F px 5.009 4 1 0 8 1101 79 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 1 0 9 1102 79 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 1 0 10 1103 79 3 Te 11 5 2 0 1 T Pdz2 8.156 4 1 0 11 1104 79 3 Te 12 5 2 1 1 T Pdxz 8.156 4 1 0 12 1105 79 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 1 0 13 1106 80 3 Te 1 5 0 0 1 F s 6.195 4 1 0 14 1107 80 3 Te 2 5 0 0 2 F s 4.205 4 1 0 15 1108 80 3 Te 3 5 1 -1 1 F py 8.156 4 1 0 16 1109 80 3 Te 4 5 1 0 1 F pz 8.156 4 1 0 17 1110 80 3 Te 5 5 1 1 1 F px 8.156 4 1 0 18 1111 80 3 Te 6 5 1 -1 2 F py 5.009 4 1 0 19 1112 80 3 Te 7 5 1 0 2 F pz 5.009 4 1 0 20 1113 80 3 Te 8 5 1 1 2 F px 5.009 4 1 0 21 1114 80 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 1 0 22 1115 80 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 1 0 23 1116 80 3 Te 11 5 2 0 1 T Pdz2 8.156 4 1 0 24 1117 80 3 Te 12 5 2 1 1 T Pdxz 8.156 4 1 0 25 1118 80 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 1 0 26 1119 81 2 Ge 1 4 0 0 1 F s 6.581 4 1 0 27 1120 81 2 Ge 2 4 0 0 2 F s 4.412 4 1 0 28 1121 81 2 Ge 3 4 1 -1 1 F py 9.340 4 1 0 29 1122 81 2 Ge 4 4 1 0 1 F pz 9.340 4 1 0 30 1123 81 2 Ge 5 4 1 1 1 F px 9.340 4 1 0 31 1124 81 2 Ge 6 4 1 -1 2 F py 5.665 4 1 0 32 1125 81 2 Ge 7 4 1 0 2 F pz 5.665 4 1 0 33 1126 81 2 Ge 8 4 1 1 2 F px 5.665 4 1 0 34 1127 81 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 1 0 35 1128 81 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 1 0 36 1129 81 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 1 0 37 1130 81 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 1 0 38 1131 81 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 1 0 39 1132 82 1 Fe 1 4 0 0 1 F s 9.649 4 1 0 40 1133 82 1 Fe 2 4 0 0 2 F s 6.885 4 1 0 41 1134 82 1 Fe 3 3 2 -2 1 F dxy 6.632 4 1 0 42 1135 82 1 Fe 4 3 2 -1 1 F dyz 6.632 4 1 0 43 1136 82 1 Fe 5 3 2 0 1 F dz2 6.632 4 1 0 44 1137 82 1 Fe 6 3 2 1 1 F dxz 6.632 4 1 0 45 1138 82 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 1 0 46 1139 82 1 Fe 8 3 2 -2 2 F dxy 2.565 4 1 0 47 1140 82 1 Fe 9 3 2 -1 2 F dyz 2.565 4 1 0 48 1141 82 1 Fe 10 3 2 0 2 F dz2 2.565 4 1 0 49 1142 82 1 Fe 11 3 2 1 2 F dxz 2.565 4 1 0 50 1143 82 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 1 0 51 1144 82 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 1 0 52 1145 82 1 Fe 14 4 1 0 1 T Ppz 9.649 4 1 0 53 1146 82 1 Fe 15 4 1 1 1 T Ppx 9.649 4 1 0 54 1147 83 1 Fe 1 4 0 0 1 F s 9.649 4 1 0 55 1148 83 1 Fe 2 4 0 0 2 F s 6.885 4 1 0 56 1149 83 1 Fe 3 3 2 -2 1 F dxy 6.632 4 1 0 57 1150 83 1 Fe 4 3 2 -1 1 F dyz 6.632 4 1 0 58 1151 83 1 Fe 5 3 2 0 1 F dz2 6.632 4 1 0 59 1152 83 1 Fe 6 3 2 1 1 F dxz 6.632 4 1 0 60 1153 83 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 1 0 61 1154 83 1 Fe 8 3 2 -2 2 F dxy 2.565 4 1 0 62 1155 83 1 Fe 9 3 2 -1 2 F dyz 2.565 4 1 0 63 1156 83 1 Fe 10 3 2 0 2 F dz2 2.565 4 1 0 64 1157 83 1 Fe 11 3 2 1 2 F dxz 2.565 4 1 0 65 1158 83 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 1 0 66 1159 83 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 1 0 67 1160 83 1 Fe 14 4 1 0 1 T Ppz 9.649 4 1 0 68 1161 83 1 Fe 15 4 1 1 1 T Ppx 9.649 4 1 0 69 1162 84 1 Fe 1 4 0 0 1 F s 9.649 4 1 0 70 1163 84 1 Fe 2 4 0 0 2 F s 6.885 4 1 0 71 1164 84 1 Fe 3 3 2 -2 1 F dxy 6.632 4 1 0 72 1165 84 1 Fe 4 3 2 -1 1 F dyz 6.632 4 1 0 73 1166 84 1 Fe 5 3 2 0 1 F dz2 6.632 4 1 0 74 1167 84 1 Fe 6 3 2 1 1 F dxz 6.632 4 1 0 75 1168 84 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 1 0 76 1169 84 1 Fe 8 3 2 -2 2 F dxy 2.565 4 1 0 77 1170 84 1 Fe 9 3 2 -1 2 F dyz 2.565 4 1 0 78 1171 84 1 Fe 10 3 2 0 2 F dz2 2.565 4 1 0 79 1172 84 1 Fe 11 3 2 1 2 F dxz 2.565 4 1 0 80 1173 84 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 1 0 81 1174 84 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 1 0 82 1175 84 1 Fe 14 4 1 0 1 T Ppz 9.649 4 1 0 83 1176 84 1 Fe 15 4 1 1 1 T Ppx 9.649 4 1 0 84 1177 85 3 Te 1 5 0 0 1 F s 6.195 -4 1 0 1 1178 85 3 Te 2 5 0 0 2 F s 4.205 -4 1 0 2 1179 85 3 Te 3 5 1 -1 1 F py 8.156 -4 1 0 3 1180 85 3 Te 4 5 1 0 1 F pz 8.156 -4 1 0 4 1181 85 3 Te 5 5 1 1 1 F px 8.156 -4 1 0 5 1182 85 3 Te 6 5 1 -1 2 F py 5.009 -4 1 0 6 1183 85 3 Te 7 5 1 0 2 F pz 5.009 -4 1 0 7 1184 85 3 Te 8 5 1 1 2 F px 5.009 -4 1 0 8 1185 85 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 1 0 9 1186 85 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 1 0 10 1187 85 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 1 0 11 1188 85 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 1 0 12 1189 85 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 1 0 13 1190 86 3 Te 1 5 0 0 1 F s 6.195 -4 1 0 14 1191 86 3 Te 2 5 0 0 2 F s 4.205 -4 1 0 15 1192 86 3 Te 3 5 1 -1 1 F py 8.156 -4 1 0 16 1193 86 3 Te 4 5 1 0 1 F pz 8.156 -4 1 0 17 1194 86 3 Te 5 5 1 1 1 F px 8.156 -4 1 0 18 1195 86 3 Te 6 5 1 -1 2 F py 5.009 -4 1 0 19 1196 86 3 Te 7 5 1 0 2 F pz 5.009 -4 1 0 20 1197 86 3 Te 8 5 1 1 2 F px 5.009 -4 1 0 21 1198 86 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 1 0 22 1199 86 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 1 0 23 1200 86 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 1 0 24 1201 86 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 1 0 25 1202 86 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 1 0 26 1203 87 2 Ge 1 4 0 0 1 F s 6.581 -4 1 0 27 1204 87 2 Ge 2 4 0 0 2 F s 4.412 -4 1 0 28 1205 87 2 Ge 3 4 1 -1 1 F py 9.340 -4 1 0 29 1206 87 2 Ge 4 4 1 0 1 F pz 9.340 -4 1 0 30 1207 87 2 Ge 5 4 1 1 1 F px 9.340 -4 1 0 31 1208 87 2 Ge 6 4 1 -1 2 F py 5.665 -4 1 0 32 1209 87 2 Ge 7 4 1 0 2 F pz 5.665 -4 1 0 33 1210 87 2 Ge 8 4 1 1 2 F px 5.665 -4 1 0 34 1211 87 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 1 0 35 1212 87 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 1 0 36 1213 87 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 1 0 37 1214 87 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 1 0 38 1215 87 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 1 0 39 1216 88 1 Fe 1 4 0 0 1 F s 9.649 -4 1 0 40 1217 88 1 Fe 2 4 0 0 2 F s 6.885 -4 1 0 41 1218 88 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 1 0 42 1219 88 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 1 0 43 1220 88 1 Fe 5 3 2 0 1 F dz2 6.632 -4 1 0 44 1221 88 1 Fe 6 3 2 1 1 F dxz 6.632 -4 1 0 45 1222 88 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 1 0 46 1223 88 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 1 0 47 1224 88 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 1 0 48 1225 88 1 Fe 10 3 2 0 2 F dz2 2.565 -4 1 0 49 1226 88 1 Fe 11 3 2 1 2 F dxz 2.565 -4 1 0 50 1227 88 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 1 0 51 1228 88 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 1 0 52 1229 88 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 1 0 53 1230 88 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 1 0 54 1231 89 1 Fe 1 4 0 0 1 F s 9.649 -4 1 0 55 1232 89 1 Fe 2 4 0 0 2 F s 6.885 -4 1 0 56 1233 89 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 1 0 57 1234 89 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 1 0 58 1235 89 1 Fe 5 3 2 0 1 F dz2 6.632 -4 1 0 59 1236 89 1 Fe 6 3 2 1 1 F dxz 6.632 -4 1 0 60 1237 89 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 1 0 61 1238 89 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 1 0 62 1239 89 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 1 0 63 1240 89 1 Fe 10 3 2 0 2 F dz2 2.565 -4 1 0 64 1241 89 1 Fe 11 3 2 1 2 F dxz 2.565 -4 1 0 65 1242 89 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 1 0 66 1243 89 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 1 0 67 1244 89 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 1 0 68 1245 89 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 1 0 69 1246 90 1 Fe 1 4 0 0 1 F s 9.649 -4 1 0 70 1247 90 1 Fe 2 4 0 0 2 F s 6.885 -4 1 0 71 1248 90 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 1 0 72 1249 90 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 1 0 73 1250 90 1 Fe 5 3 2 0 1 F dz2 6.632 -4 1 0 74 1251 90 1 Fe 6 3 2 1 1 F dxz 6.632 -4 1 0 75 1252 90 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 1 0 76 1253 90 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 1 0 77 1254 90 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 1 0 78 1255 90 1 Fe 10 3 2 0 2 F dz2 2.565 -4 1 0 79 1256 90 1 Fe 11 3 2 1 2 F dxz 2.565 -4 1 0 80 1257 90 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 1 0 81 1258 90 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 1 0 82 1259 90 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 1 0 83 1260 90 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 1 0 84 1261 91 3 Te 1 5 0 0 1 F s 6.195 -3 1 0 1 1262 91 3 Te 2 5 0 0 2 F s 4.205 -3 1 0 2 1263 91 3 Te 3 5 1 -1 1 F py 8.156 -3 1 0 3 1264 91 3 Te 4 5 1 0 1 F pz 8.156 -3 1 0 4 1265 91 3 Te 5 5 1 1 1 F px 8.156 -3 1 0 5 1266 91 3 Te 6 5 1 -1 2 F py 5.009 -3 1 0 6 1267 91 3 Te 7 5 1 0 2 F pz 5.009 -3 1 0 7 1268 91 3 Te 8 5 1 1 2 F px 5.009 -3 1 0 8 1269 91 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 1 0 9 1270 91 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 1 0 10 1271 91 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 1 0 11 1272 91 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 1 0 12 1273 91 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 1 0 13 1274 92 3 Te 1 5 0 0 1 F s 6.195 -3 1 0 14 1275 92 3 Te 2 5 0 0 2 F s 4.205 -3 1 0 15 1276 92 3 Te 3 5 1 -1 1 F py 8.156 -3 1 0 16 1277 92 3 Te 4 5 1 0 1 F pz 8.156 -3 1 0 17 1278 92 3 Te 5 5 1 1 1 F px 8.156 -3 1 0 18 1279 92 3 Te 6 5 1 -1 2 F py 5.009 -3 1 0 19 1280 92 3 Te 7 5 1 0 2 F pz 5.009 -3 1 0 20 1281 92 3 Te 8 5 1 1 2 F px 5.009 -3 1 0 21 1282 92 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 1 0 22 1283 92 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 1 0 23 1284 92 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 1 0 24 1285 92 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 1 0 25 1286 92 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 1 0 26 1287 93 2 Ge 1 4 0 0 1 F s 6.581 -3 1 0 27 1288 93 2 Ge 2 4 0 0 2 F s 4.412 -3 1 0 28 1289 93 2 Ge 3 4 1 -1 1 F py 9.340 -3 1 0 29 1290 93 2 Ge 4 4 1 0 1 F pz 9.340 -3 1 0 30 1291 93 2 Ge 5 4 1 1 1 F px 9.340 -3 1 0 31 1292 93 2 Ge 6 4 1 -1 2 F py 5.665 -3 1 0 32 1293 93 2 Ge 7 4 1 0 2 F pz 5.665 -3 1 0 33 1294 93 2 Ge 8 4 1 1 2 F px 5.665 -3 1 0 34 1295 93 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 1 0 35 1296 93 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 1 0 36 1297 93 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 1 0 37 1298 93 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 1 0 38 1299 93 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 1 0 39 1300 94 1 Fe 1 4 0 0 1 F s 9.649 -3 1 0 40 1301 94 1 Fe 2 4 0 0 2 F s 6.885 -3 1 0 41 1302 94 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 1 0 42 1303 94 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 1 0 43 1304 94 1 Fe 5 3 2 0 1 F dz2 6.632 -3 1 0 44 1305 94 1 Fe 6 3 2 1 1 F dxz 6.632 -3 1 0 45 1306 94 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 1 0 46 1307 94 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 1 0 47 1308 94 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 1 0 48 1309 94 1 Fe 10 3 2 0 2 F dz2 2.565 -3 1 0 49 1310 94 1 Fe 11 3 2 1 2 F dxz 2.565 -3 1 0 50 1311 94 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 1 0 51 1312 94 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 1 0 52 1313 94 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 1 0 53 1314 94 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 1 0 54 1315 95 1 Fe 1 4 0 0 1 F s 9.649 -3 1 0 55 1316 95 1 Fe 2 4 0 0 2 F s 6.885 -3 1 0 56 1317 95 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 1 0 57 1318 95 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 1 0 58 1319 95 1 Fe 5 3 2 0 1 F dz2 6.632 -3 1 0 59 1320 95 1 Fe 6 3 2 1 1 F dxz 6.632 -3 1 0 60 1321 95 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 1 0 61 1322 95 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 1 0 62 1323 95 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 1 0 63 1324 95 1 Fe 10 3 2 0 2 F dz2 2.565 -3 1 0 64 1325 95 1 Fe 11 3 2 1 2 F dxz 2.565 -3 1 0 65 1326 95 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 1 0 66 1327 95 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 1 0 67 1328 95 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 1 0 68 1329 95 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 1 0 69 1330 96 1 Fe 1 4 0 0 1 F s 9.649 -3 1 0 70 1331 96 1 Fe 2 4 0 0 2 F s 6.885 -3 1 0 71 1332 96 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 1 0 72 1333 96 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 1 0 73 1334 96 1 Fe 5 3 2 0 1 F dz2 6.632 -3 1 0 74 1335 96 1 Fe 6 3 2 1 1 F dxz 6.632 -3 1 0 75 1336 96 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 1 0 76 1337 96 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 1 0 77 1338 96 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 1 0 78 1339 96 1 Fe 10 3 2 0 2 F dz2 2.565 -3 1 0 79 1340 96 1 Fe 11 3 2 1 2 F dxz 2.565 -3 1 0 80 1341 96 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 1 0 81 1342 96 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 1 0 82 1343 96 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 1 0 83 1344 96 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 1 0 84 1345 97 3 Te 1 5 0 0 1 F s 6.195 -2 1 0 1 1346 97 3 Te 2 5 0 0 2 F s 4.205 -2 1 0 2 1347 97 3 Te 3 5 1 -1 1 F py 8.156 -2 1 0 3 1348 97 3 Te 4 5 1 0 1 F pz 8.156 -2 1 0 4 1349 97 3 Te 5 5 1 1 1 F px 8.156 -2 1 0 5 1350 97 3 Te 6 5 1 -1 2 F py 5.009 -2 1 0 6 1351 97 3 Te 7 5 1 0 2 F pz 5.009 -2 1 0 7 1352 97 3 Te 8 5 1 1 2 F px 5.009 -2 1 0 8 1353 97 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 1 0 9 1354 97 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 1 0 10 1355 97 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 1 0 11 1356 97 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 1 0 12 1357 97 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 1 0 13 1358 98 3 Te 1 5 0 0 1 F s 6.195 -2 1 0 14 1359 98 3 Te 2 5 0 0 2 F s 4.205 -2 1 0 15 1360 98 3 Te 3 5 1 -1 1 F py 8.156 -2 1 0 16 1361 98 3 Te 4 5 1 0 1 F pz 8.156 -2 1 0 17 1362 98 3 Te 5 5 1 1 1 F px 8.156 -2 1 0 18 1363 98 3 Te 6 5 1 -1 2 F py 5.009 -2 1 0 19 1364 98 3 Te 7 5 1 0 2 F pz 5.009 -2 1 0 20 1365 98 3 Te 8 5 1 1 2 F px 5.009 -2 1 0 21 1366 98 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 1 0 22 1367 98 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 1 0 23 1368 98 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 1 0 24 1369 98 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 1 0 25 1370 98 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 1 0 26 1371 99 2 Ge 1 4 0 0 1 F s 6.581 -2 1 0 27 1372 99 2 Ge 2 4 0 0 2 F s 4.412 -2 1 0 28 1373 99 2 Ge 3 4 1 -1 1 F py 9.340 -2 1 0 29 1374 99 2 Ge 4 4 1 0 1 F pz 9.340 -2 1 0 30 1375 99 2 Ge 5 4 1 1 1 F px 9.340 -2 1 0 31 1376 99 2 Ge 6 4 1 -1 2 F py 5.665 -2 1 0 32 1377 99 2 Ge 7 4 1 0 2 F pz 5.665 -2 1 0 33 1378 99 2 Ge 8 4 1 1 2 F px 5.665 -2 1 0 34 1379 99 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 1 0 35 1380 99 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 1 0 36 1381 99 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 1 0 37 1382 99 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 1 0 38 1383 99 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 1 0 39 1384 100 1 Fe 1 4 0 0 1 F s 9.649 -2 1 0 40 1385 100 1 Fe 2 4 0 0 2 F s 6.885 -2 1 0 41 1386 100 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 1 0 42 1387 100 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 1 0 43 1388 100 1 Fe 5 3 2 0 1 F dz2 6.632 -2 1 0 44 1389 100 1 Fe 6 3 2 1 1 F dxz 6.632 -2 1 0 45 1390 100 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 1 0 46 1391 100 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 1 0 47 1392 100 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 1 0 48 1393 100 1 Fe 10 3 2 0 2 F dz2 2.565 -2 1 0 49 1394 100 1 Fe 11 3 2 1 2 F dxz 2.565 -2 1 0 50 1395 100 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 1 0 51 1396 100 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 1 0 52 1397 100 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 1 0 53 1398 100 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 1 0 54 1399 101 1 Fe 1 4 0 0 1 F s 9.649 -2 1 0 55 1400 101 1 Fe 2 4 0 0 2 F s 6.885 -2 1 0 56 1401 101 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 1 0 57 1402 101 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 1 0 58 1403 101 1 Fe 5 3 2 0 1 F dz2 6.632 -2 1 0 59 1404 101 1 Fe 6 3 2 1 1 F dxz 6.632 -2 1 0 60 1405 101 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 1 0 61 1406 101 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 1 0 62 1407 101 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 1 0 63 1408 101 1 Fe 10 3 2 0 2 F dz2 2.565 -2 1 0 64 1409 101 1 Fe 11 3 2 1 2 F dxz 2.565 -2 1 0 65 1410 101 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 1 0 66 1411 101 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 1 0 67 1412 101 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 1 0 68 1413 101 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 1 0 69 1414 102 1 Fe 1 4 0 0 1 F s 9.649 -2 1 0 70 1415 102 1 Fe 2 4 0 0 2 F s 6.885 -2 1 0 71 1416 102 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 1 0 72 1417 102 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 1 0 73 1418 102 1 Fe 5 3 2 0 1 F dz2 6.632 -2 1 0 74 1419 102 1 Fe 6 3 2 1 1 F dxz 6.632 -2 1 0 75 1420 102 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 1 0 76 1421 102 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 1 0 77 1422 102 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 1 0 78 1423 102 1 Fe 10 3 2 0 2 F dz2 2.565 -2 1 0 79 1424 102 1 Fe 11 3 2 1 2 F dxz 2.565 -2 1 0 80 1425 102 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 1 0 81 1426 102 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 1 0 82 1427 102 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 1 0 83 1428 102 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 1 0 84 1429 103 3 Te 1 5 0 0 1 F s 6.195 -1 1 0 1 1430 103 3 Te 2 5 0 0 2 F s 4.205 -1 1 0 2 1431 103 3 Te 3 5 1 -1 1 F py 8.156 -1 1 0 3 1432 103 3 Te 4 5 1 0 1 F pz 8.156 -1 1 0 4 1433 103 3 Te 5 5 1 1 1 F px 8.156 -1 1 0 5 1434 103 3 Te 6 5 1 -1 2 F py 5.009 -1 1 0 6 1435 103 3 Te 7 5 1 0 2 F pz 5.009 -1 1 0 7 1436 103 3 Te 8 5 1 1 2 F px 5.009 -1 1 0 8 1437 103 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 1 0 9 1438 103 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 1 0 10 1439 103 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 1 0 11 1440 103 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 1 0 12 1441 103 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 1 0 13 1442 104 3 Te 1 5 0 0 1 F s 6.195 -1 1 0 14 1443 104 3 Te 2 5 0 0 2 F s 4.205 -1 1 0 15 1444 104 3 Te 3 5 1 -1 1 F py 8.156 -1 1 0 16 1445 104 3 Te 4 5 1 0 1 F pz 8.156 -1 1 0 17 1446 104 3 Te 5 5 1 1 1 F px 8.156 -1 1 0 18 1447 104 3 Te 6 5 1 -1 2 F py 5.009 -1 1 0 19 1448 104 3 Te 7 5 1 0 2 F pz 5.009 -1 1 0 20 1449 104 3 Te 8 5 1 1 2 F px 5.009 -1 1 0 21 1450 104 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 1 0 22 1451 104 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 1 0 23 1452 104 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 1 0 24 1453 104 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 1 0 25 1454 104 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 1 0 26 1455 105 2 Ge 1 4 0 0 1 F s 6.581 -1 1 0 27 1456 105 2 Ge 2 4 0 0 2 F s 4.412 -1 1 0 28 1457 105 2 Ge 3 4 1 -1 1 F py 9.340 -1 1 0 29 1458 105 2 Ge 4 4 1 0 1 F pz 9.340 -1 1 0 30 1459 105 2 Ge 5 4 1 1 1 F px 9.340 -1 1 0 31 1460 105 2 Ge 6 4 1 -1 2 F py 5.665 -1 1 0 32 1461 105 2 Ge 7 4 1 0 2 F pz 5.665 -1 1 0 33 1462 105 2 Ge 8 4 1 1 2 F px 5.665 -1 1 0 34 1463 105 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 1 0 35 1464 105 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 1 0 36 1465 105 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 1 0 37 1466 105 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 1 0 38 1467 105 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 1 0 39 1468 106 1 Fe 1 4 0 0 1 F s 9.649 -1 1 0 40 1469 106 1 Fe 2 4 0 0 2 F s 6.885 -1 1 0 41 1470 106 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 1 0 42 1471 106 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 1 0 43 1472 106 1 Fe 5 3 2 0 1 F dz2 6.632 -1 1 0 44 1473 106 1 Fe 6 3 2 1 1 F dxz 6.632 -1 1 0 45 1474 106 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 1 0 46 1475 106 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 1 0 47 1476 106 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 1 0 48 1477 106 1 Fe 10 3 2 0 2 F dz2 2.565 -1 1 0 49 1478 106 1 Fe 11 3 2 1 2 F dxz 2.565 -1 1 0 50 1479 106 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 1 0 51 1480 106 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 1 0 52 1481 106 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 1 0 53 1482 106 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 1 0 54 1483 107 1 Fe 1 4 0 0 1 F s 9.649 -1 1 0 55 1484 107 1 Fe 2 4 0 0 2 F s 6.885 -1 1 0 56 1485 107 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 1 0 57 1486 107 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 1 0 58 1487 107 1 Fe 5 3 2 0 1 F dz2 6.632 -1 1 0 59 1488 107 1 Fe 6 3 2 1 1 F dxz 6.632 -1 1 0 60 1489 107 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 1 0 61 1490 107 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 1 0 62 1491 107 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 1 0 63 1492 107 1 Fe 10 3 2 0 2 F dz2 2.565 -1 1 0 64 1493 107 1 Fe 11 3 2 1 2 F dxz 2.565 -1 1 0 65 1494 107 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 1 0 66 1495 107 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 1 0 67 1496 107 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 1 0 68 1497 107 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 1 0 69 1498 108 1 Fe 1 4 0 0 1 F s 9.649 -1 1 0 70 1499 108 1 Fe 2 4 0 0 2 F s 6.885 -1 1 0 71 1500 108 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 1 0 72 1501 108 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 1 0 73 1502 108 1 Fe 5 3 2 0 1 F dz2 6.632 -1 1 0 74 1503 108 1 Fe 6 3 2 1 1 F dxz 6.632 -1 1 0 75 1504 108 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 1 0 76 1505 108 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 1 0 77 1506 108 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 1 0 78 1507 108 1 Fe 10 3 2 0 2 F dz2 2.565 -1 1 0 79 1508 108 1 Fe 11 3 2 1 2 F dxz 2.565 -1 1 0 80 1509 108 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 1 0 81 1510 108 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 1 0 82 1511 108 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 1 0 83 1512 108 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 1 0 84 1513 109 3 Te 1 5 0 0 1 F s 6.195 0 2 0 1 1514 109 3 Te 2 5 0 0 2 F s 4.205 0 2 0 2 1515 109 3 Te 3 5 1 -1 1 F py 8.156 0 2 0 3 1516 109 3 Te 4 5 1 0 1 F pz 8.156 0 2 0 4 1517 109 3 Te 5 5 1 1 1 F px 8.156 0 2 0 5 1518 109 3 Te 6 5 1 -1 2 F py 5.009 0 2 0 6 1519 109 3 Te 7 5 1 0 2 F pz 5.009 0 2 0 7 1520 109 3 Te 8 5 1 1 2 F px 5.009 0 2 0 8 1521 109 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 2 0 9 1522 109 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 2 0 10 1523 109 3 Te 11 5 2 0 1 T Pdz2 8.156 0 2 0 11 1524 109 3 Te 12 5 2 1 1 T Pdxz 8.156 0 2 0 12 1525 109 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 2 0 13 1526 110 3 Te 1 5 0 0 1 F s 6.195 0 2 0 14 1527 110 3 Te 2 5 0 0 2 F s 4.205 0 2 0 15 1528 110 3 Te 3 5 1 -1 1 F py 8.156 0 2 0 16 1529 110 3 Te 4 5 1 0 1 F pz 8.156 0 2 0 17 1530 110 3 Te 5 5 1 1 1 F px 8.156 0 2 0 18 1531 110 3 Te 6 5 1 -1 2 F py 5.009 0 2 0 19 1532 110 3 Te 7 5 1 0 2 F pz 5.009 0 2 0 20 1533 110 3 Te 8 5 1 1 2 F px 5.009 0 2 0 21 1534 110 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 2 0 22 1535 110 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 2 0 23 1536 110 3 Te 11 5 2 0 1 T Pdz2 8.156 0 2 0 24 1537 110 3 Te 12 5 2 1 1 T Pdxz 8.156 0 2 0 25 1538 110 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 2 0 26 1539 111 2 Ge 1 4 0 0 1 F s 6.581 0 2 0 27 1540 111 2 Ge 2 4 0 0 2 F s 4.412 0 2 0 28 1541 111 2 Ge 3 4 1 -1 1 F py 9.340 0 2 0 29 1542 111 2 Ge 4 4 1 0 1 F pz 9.340 0 2 0 30 1543 111 2 Ge 5 4 1 1 1 F px 9.340 0 2 0 31 1544 111 2 Ge 6 4 1 -1 2 F py 5.665 0 2 0 32 1545 111 2 Ge 7 4 1 0 2 F pz 5.665 0 2 0 33 1546 111 2 Ge 8 4 1 1 2 F px 5.665 0 2 0 34 1547 111 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 2 0 35 1548 111 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 2 0 36 1549 111 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 2 0 37 1550 111 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 2 0 38 1551 111 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 2 0 39 1552 112 1 Fe 1 4 0 0 1 F s 9.649 0 2 0 40 1553 112 1 Fe 2 4 0 0 2 F s 6.885 0 2 0 41 1554 112 1 Fe 3 3 2 -2 1 F dxy 6.632 0 2 0 42 1555 112 1 Fe 4 3 2 -1 1 F dyz 6.632 0 2 0 43 1556 112 1 Fe 5 3 2 0 1 F dz2 6.632 0 2 0 44 1557 112 1 Fe 6 3 2 1 1 F dxz 6.632 0 2 0 45 1558 112 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 2 0 46 1559 112 1 Fe 8 3 2 -2 2 F dxy 2.565 0 2 0 47 1560 112 1 Fe 9 3 2 -1 2 F dyz 2.565 0 2 0 48 1561 112 1 Fe 10 3 2 0 2 F dz2 2.565 0 2 0 49 1562 112 1 Fe 11 3 2 1 2 F dxz 2.565 0 2 0 50 1563 112 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 2 0 51 1564 112 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 2 0 52 1565 112 1 Fe 14 4 1 0 1 T Ppz 9.649 0 2 0 53 1566 112 1 Fe 15 4 1 1 1 T Ppx 9.649 0 2 0 54 1567 113 1 Fe 1 4 0 0 1 F s 9.649 0 2 0 55 1568 113 1 Fe 2 4 0 0 2 F s 6.885 0 2 0 56 1569 113 1 Fe 3 3 2 -2 1 F dxy 6.632 0 2 0 57 1570 113 1 Fe 4 3 2 -1 1 F dyz 6.632 0 2 0 58 1571 113 1 Fe 5 3 2 0 1 F dz2 6.632 0 2 0 59 1572 113 1 Fe 6 3 2 1 1 F dxz 6.632 0 2 0 60 1573 113 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 2 0 61 1574 113 1 Fe 8 3 2 -2 2 F dxy 2.565 0 2 0 62 1575 113 1 Fe 9 3 2 -1 2 F dyz 2.565 0 2 0 63 1576 113 1 Fe 10 3 2 0 2 F dz2 2.565 0 2 0 64 1577 113 1 Fe 11 3 2 1 2 F dxz 2.565 0 2 0 65 1578 113 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 2 0 66 1579 113 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 2 0 67 1580 113 1 Fe 14 4 1 0 1 T Ppz 9.649 0 2 0 68 1581 113 1 Fe 15 4 1 1 1 T Ppx 9.649 0 2 0 69 1582 114 1 Fe 1 4 0 0 1 F s 9.649 0 2 0 70 1583 114 1 Fe 2 4 0 0 2 F s 6.885 0 2 0 71 1584 114 1 Fe 3 3 2 -2 1 F dxy 6.632 0 2 0 72 1585 114 1 Fe 4 3 2 -1 1 F dyz 6.632 0 2 0 73 1586 114 1 Fe 5 3 2 0 1 F dz2 6.632 0 2 0 74 1587 114 1 Fe 6 3 2 1 1 F dxz 6.632 0 2 0 75 1588 114 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 2 0 76 1589 114 1 Fe 8 3 2 -2 2 F dxy 2.565 0 2 0 77 1590 114 1 Fe 9 3 2 -1 2 F dyz 2.565 0 2 0 78 1591 114 1 Fe 10 3 2 0 2 F dz2 2.565 0 2 0 79 1592 114 1 Fe 11 3 2 1 2 F dxz 2.565 0 2 0 80 1593 114 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 2 0 81 1594 114 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 2 0 82 1595 114 1 Fe 14 4 1 0 1 T Ppz 9.649 0 2 0 83 1596 114 1 Fe 15 4 1 1 1 T Ppx 9.649 0 2 0 84 1597 115 3 Te 1 5 0 0 1 F s 6.195 1 2 0 1 1598 115 3 Te 2 5 0 0 2 F s 4.205 1 2 0 2 1599 115 3 Te 3 5 1 -1 1 F py 8.156 1 2 0 3 1600 115 3 Te 4 5 1 0 1 F pz 8.156 1 2 0 4 1601 115 3 Te 5 5 1 1 1 F px 8.156 1 2 0 5 1602 115 3 Te 6 5 1 -1 2 F py 5.009 1 2 0 6 1603 115 3 Te 7 5 1 0 2 F pz 5.009 1 2 0 7 1604 115 3 Te 8 5 1 1 2 F px 5.009 1 2 0 8 1605 115 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 2 0 9 1606 115 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 2 0 10 1607 115 3 Te 11 5 2 0 1 T Pdz2 8.156 1 2 0 11 1608 115 3 Te 12 5 2 1 1 T Pdxz 8.156 1 2 0 12 1609 115 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 2 0 13 1610 116 3 Te 1 5 0 0 1 F s 6.195 1 2 0 14 1611 116 3 Te 2 5 0 0 2 F s 4.205 1 2 0 15 1612 116 3 Te 3 5 1 -1 1 F py 8.156 1 2 0 16 1613 116 3 Te 4 5 1 0 1 F pz 8.156 1 2 0 17 1614 116 3 Te 5 5 1 1 1 F px 8.156 1 2 0 18 1615 116 3 Te 6 5 1 -1 2 F py 5.009 1 2 0 19 1616 116 3 Te 7 5 1 0 2 F pz 5.009 1 2 0 20 1617 116 3 Te 8 5 1 1 2 F px 5.009 1 2 0 21 1618 116 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 2 0 22 1619 116 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 2 0 23 1620 116 3 Te 11 5 2 0 1 T Pdz2 8.156 1 2 0 24 1621 116 3 Te 12 5 2 1 1 T Pdxz 8.156 1 2 0 25 1622 116 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 2 0 26 1623 117 2 Ge 1 4 0 0 1 F s 6.581 1 2 0 27 1624 117 2 Ge 2 4 0 0 2 F s 4.412 1 2 0 28 1625 117 2 Ge 3 4 1 -1 1 F py 9.340 1 2 0 29 1626 117 2 Ge 4 4 1 0 1 F pz 9.340 1 2 0 30 1627 117 2 Ge 5 4 1 1 1 F px 9.340 1 2 0 31 1628 117 2 Ge 6 4 1 -1 2 F py 5.665 1 2 0 32 1629 117 2 Ge 7 4 1 0 2 F pz 5.665 1 2 0 33 1630 117 2 Ge 8 4 1 1 2 F px 5.665 1 2 0 34 1631 117 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 2 0 35 1632 117 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 2 0 36 1633 117 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 2 0 37 1634 117 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 2 0 38 1635 117 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 2 0 39 1636 118 1 Fe 1 4 0 0 1 F s 9.649 1 2 0 40 1637 118 1 Fe 2 4 0 0 2 F s 6.885 1 2 0 41 1638 118 1 Fe 3 3 2 -2 1 F dxy 6.632 1 2 0 42 1639 118 1 Fe 4 3 2 -1 1 F dyz 6.632 1 2 0 43 1640 118 1 Fe 5 3 2 0 1 F dz2 6.632 1 2 0 44 1641 118 1 Fe 6 3 2 1 1 F dxz 6.632 1 2 0 45 1642 118 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 2 0 46 1643 118 1 Fe 8 3 2 -2 2 F dxy 2.565 1 2 0 47 1644 118 1 Fe 9 3 2 -1 2 F dyz 2.565 1 2 0 48 1645 118 1 Fe 10 3 2 0 2 F dz2 2.565 1 2 0 49 1646 118 1 Fe 11 3 2 1 2 F dxz 2.565 1 2 0 50 1647 118 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 2 0 51 1648 118 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 2 0 52 1649 118 1 Fe 14 4 1 0 1 T Ppz 9.649 1 2 0 53 1650 118 1 Fe 15 4 1 1 1 T Ppx 9.649 1 2 0 54 1651 119 1 Fe 1 4 0 0 1 F s 9.649 1 2 0 55 1652 119 1 Fe 2 4 0 0 2 F s 6.885 1 2 0 56 1653 119 1 Fe 3 3 2 -2 1 F dxy 6.632 1 2 0 57 1654 119 1 Fe 4 3 2 -1 1 F dyz 6.632 1 2 0 58 1655 119 1 Fe 5 3 2 0 1 F dz2 6.632 1 2 0 59 1656 119 1 Fe 6 3 2 1 1 F dxz 6.632 1 2 0 60 1657 119 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 2 0 61 1658 119 1 Fe 8 3 2 -2 2 F dxy 2.565 1 2 0 62 1659 119 1 Fe 9 3 2 -1 2 F dyz 2.565 1 2 0 63 1660 119 1 Fe 10 3 2 0 2 F dz2 2.565 1 2 0 64 1661 119 1 Fe 11 3 2 1 2 F dxz 2.565 1 2 0 65 1662 119 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 2 0 66 1663 119 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 2 0 67 1664 119 1 Fe 14 4 1 0 1 T Ppz 9.649 1 2 0 68 1665 119 1 Fe 15 4 1 1 1 T Ppx 9.649 1 2 0 69 1666 120 1 Fe 1 4 0 0 1 F s 9.649 1 2 0 70 1667 120 1 Fe 2 4 0 0 2 F s 6.885 1 2 0 71 1668 120 1 Fe 3 3 2 -2 1 F dxy 6.632 1 2 0 72 1669 120 1 Fe 4 3 2 -1 1 F dyz 6.632 1 2 0 73 1670 120 1 Fe 5 3 2 0 1 F dz2 6.632 1 2 0 74 1671 120 1 Fe 6 3 2 1 1 F dxz 6.632 1 2 0 75 1672 120 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 2 0 76 1673 120 1 Fe 8 3 2 -2 2 F dxy 2.565 1 2 0 77 1674 120 1 Fe 9 3 2 -1 2 F dyz 2.565 1 2 0 78 1675 120 1 Fe 10 3 2 0 2 F dz2 2.565 1 2 0 79 1676 120 1 Fe 11 3 2 1 2 F dxz 2.565 1 2 0 80 1677 120 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 2 0 81 1678 120 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 2 0 82 1679 120 1 Fe 14 4 1 0 1 T Ppz 9.649 1 2 0 83 1680 120 1 Fe 15 4 1 1 1 T Ppx 9.649 1 2 0 84 1681 121 3 Te 1 5 0 0 1 F s 6.195 2 2 0 1 1682 121 3 Te 2 5 0 0 2 F s 4.205 2 2 0 2 1683 121 3 Te 3 5 1 -1 1 F py 8.156 2 2 0 3 1684 121 3 Te 4 5 1 0 1 F pz 8.156 2 2 0 4 1685 121 3 Te 5 5 1 1 1 F px 8.156 2 2 0 5 1686 121 3 Te 6 5 1 -1 2 F py 5.009 2 2 0 6 1687 121 3 Te 7 5 1 0 2 F pz 5.009 2 2 0 7 1688 121 3 Te 8 5 1 1 2 F px 5.009 2 2 0 8 1689 121 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 2 0 9 1690 121 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 2 0 10 1691 121 3 Te 11 5 2 0 1 T Pdz2 8.156 2 2 0 11 1692 121 3 Te 12 5 2 1 1 T Pdxz 8.156 2 2 0 12 1693 121 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 2 0 13 1694 122 3 Te 1 5 0 0 1 F s 6.195 2 2 0 14 1695 122 3 Te 2 5 0 0 2 F s 4.205 2 2 0 15 1696 122 3 Te 3 5 1 -1 1 F py 8.156 2 2 0 16 1697 122 3 Te 4 5 1 0 1 F pz 8.156 2 2 0 17 1698 122 3 Te 5 5 1 1 1 F px 8.156 2 2 0 18 1699 122 3 Te 6 5 1 -1 2 F py 5.009 2 2 0 19 1700 122 3 Te 7 5 1 0 2 F pz 5.009 2 2 0 20 1701 122 3 Te 8 5 1 1 2 F px 5.009 2 2 0 21 1702 122 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 2 0 22 1703 122 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 2 0 23 1704 122 3 Te 11 5 2 0 1 T Pdz2 8.156 2 2 0 24 1705 122 3 Te 12 5 2 1 1 T Pdxz 8.156 2 2 0 25 1706 122 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 2 0 26 1707 123 2 Ge 1 4 0 0 1 F s 6.581 2 2 0 27 1708 123 2 Ge 2 4 0 0 2 F s 4.412 2 2 0 28 1709 123 2 Ge 3 4 1 -1 1 F py 9.340 2 2 0 29 1710 123 2 Ge 4 4 1 0 1 F pz 9.340 2 2 0 30 1711 123 2 Ge 5 4 1 1 1 F px 9.340 2 2 0 31 1712 123 2 Ge 6 4 1 -1 2 F py 5.665 2 2 0 32 1713 123 2 Ge 7 4 1 0 2 F pz 5.665 2 2 0 33 1714 123 2 Ge 8 4 1 1 2 F px 5.665 2 2 0 34 1715 123 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 2 0 35 1716 123 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 2 0 36 1717 123 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 2 0 37 1718 123 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 2 0 38 1719 123 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 2 0 39 1720 124 1 Fe 1 4 0 0 1 F s 9.649 2 2 0 40 1721 124 1 Fe 2 4 0 0 2 F s 6.885 2 2 0 41 1722 124 1 Fe 3 3 2 -2 1 F dxy 6.632 2 2 0 42 1723 124 1 Fe 4 3 2 -1 1 F dyz 6.632 2 2 0 43 1724 124 1 Fe 5 3 2 0 1 F dz2 6.632 2 2 0 44 1725 124 1 Fe 6 3 2 1 1 F dxz 6.632 2 2 0 45 1726 124 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 2 0 46 1727 124 1 Fe 8 3 2 -2 2 F dxy 2.565 2 2 0 47 1728 124 1 Fe 9 3 2 -1 2 F dyz 2.565 2 2 0 48 1729 124 1 Fe 10 3 2 0 2 F dz2 2.565 2 2 0 49 1730 124 1 Fe 11 3 2 1 2 F dxz 2.565 2 2 0 50 1731 124 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 2 0 51 1732 124 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 2 0 52 1733 124 1 Fe 14 4 1 0 1 T Ppz 9.649 2 2 0 53 1734 124 1 Fe 15 4 1 1 1 T Ppx 9.649 2 2 0 54 1735 125 1 Fe 1 4 0 0 1 F s 9.649 2 2 0 55 1736 125 1 Fe 2 4 0 0 2 F s 6.885 2 2 0 56 1737 125 1 Fe 3 3 2 -2 1 F dxy 6.632 2 2 0 57 1738 125 1 Fe 4 3 2 -1 1 F dyz 6.632 2 2 0 58 1739 125 1 Fe 5 3 2 0 1 F dz2 6.632 2 2 0 59 1740 125 1 Fe 6 3 2 1 1 F dxz 6.632 2 2 0 60 1741 125 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 2 0 61 1742 125 1 Fe 8 3 2 -2 2 F dxy 2.565 2 2 0 62 1743 125 1 Fe 9 3 2 -1 2 F dyz 2.565 2 2 0 63 1744 125 1 Fe 10 3 2 0 2 F dz2 2.565 2 2 0 64 1745 125 1 Fe 11 3 2 1 2 F dxz 2.565 2 2 0 65 1746 125 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 2 0 66 1747 125 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 2 0 67 1748 125 1 Fe 14 4 1 0 1 T Ppz 9.649 2 2 0 68 1749 125 1 Fe 15 4 1 1 1 T Ppx 9.649 2 2 0 69 1750 126 1 Fe 1 4 0 0 1 F s 9.649 2 2 0 70 1751 126 1 Fe 2 4 0 0 2 F s 6.885 2 2 0 71 1752 126 1 Fe 3 3 2 -2 1 F dxy 6.632 2 2 0 72 1753 126 1 Fe 4 3 2 -1 1 F dyz 6.632 2 2 0 73 1754 126 1 Fe 5 3 2 0 1 F dz2 6.632 2 2 0 74 1755 126 1 Fe 6 3 2 1 1 F dxz 6.632 2 2 0 75 1756 126 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 2 0 76 1757 126 1 Fe 8 3 2 -2 2 F dxy 2.565 2 2 0 77 1758 126 1 Fe 9 3 2 -1 2 F dyz 2.565 2 2 0 78 1759 126 1 Fe 10 3 2 0 2 F dz2 2.565 2 2 0 79 1760 126 1 Fe 11 3 2 1 2 F dxz 2.565 2 2 0 80 1761 126 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 2 0 81 1762 126 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 2 0 82 1763 126 1 Fe 14 4 1 0 1 T Ppz 9.649 2 2 0 83 1764 126 1 Fe 15 4 1 1 1 T Ppx 9.649 2 2 0 84 1765 127 3 Te 1 5 0 0 1 F s 6.195 3 2 0 1 1766 127 3 Te 2 5 0 0 2 F s 4.205 3 2 0 2 1767 127 3 Te 3 5 1 -1 1 F py 8.156 3 2 0 3 1768 127 3 Te 4 5 1 0 1 F pz 8.156 3 2 0 4 1769 127 3 Te 5 5 1 1 1 F px 8.156 3 2 0 5 1770 127 3 Te 6 5 1 -1 2 F py 5.009 3 2 0 6 1771 127 3 Te 7 5 1 0 2 F pz 5.009 3 2 0 7 1772 127 3 Te 8 5 1 1 2 F px 5.009 3 2 0 8 1773 127 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 2 0 9 1774 127 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 2 0 10 1775 127 3 Te 11 5 2 0 1 T Pdz2 8.156 3 2 0 11 1776 127 3 Te 12 5 2 1 1 T Pdxz 8.156 3 2 0 12 1777 127 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 2 0 13 1778 128 3 Te 1 5 0 0 1 F s 6.195 3 2 0 14 1779 128 3 Te 2 5 0 0 2 F s 4.205 3 2 0 15 1780 128 3 Te 3 5 1 -1 1 F py 8.156 3 2 0 16 1781 128 3 Te 4 5 1 0 1 F pz 8.156 3 2 0 17 1782 128 3 Te 5 5 1 1 1 F px 8.156 3 2 0 18 1783 128 3 Te 6 5 1 -1 2 F py 5.009 3 2 0 19 1784 128 3 Te 7 5 1 0 2 F pz 5.009 3 2 0 20 1785 128 3 Te 8 5 1 1 2 F px 5.009 3 2 0 21 1786 128 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 2 0 22 1787 128 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 2 0 23 1788 128 3 Te 11 5 2 0 1 T Pdz2 8.156 3 2 0 24 1789 128 3 Te 12 5 2 1 1 T Pdxz 8.156 3 2 0 25 1790 128 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 2 0 26 1791 129 2 Ge 1 4 0 0 1 F s 6.581 3 2 0 27 1792 129 2 Ge 2 4 0 0 2 F s 4.412 3 2 0 28 1793 129 2 Ge 3 4 1 -1 1 F py 9.340 3 2 0 29 1794 129 2 Ge 4 4 1 0 1 F pz 9.340 3 2 0 30 1795 129 2 Ge 5 4 1 1 1 F px 9.340 3 2 0 31 1796 129 2 Ge 6 4 1 -1 2 F py 5.665 3 2 0 32 1797 129 2 Ge 7 4 1 0 2 F pz 5.665 3 2 0 33 1798 129 2 Ge 8 4 1 1 2 F px 5.665 3 2 0 34 1799 129 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 2 0 35 1800 129 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 2 0 36 1801 129 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 2 0 37 1802 129 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 2 0 38 1803 129 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 2 0 39 1804 130 1 Fe 1 4 0 0 1 F s 9.649 3 2 0 40 1805 130 1 Fe 2 4 0 0 2 F s 6.885 3 2 0 41 1806 130 1 Fe 3 3 2 -2 1 F dxy 6.632 3 2 0 42 1807 130 1 Fe 4 3 2 -1 1 F dyz 6.632 3 2 0 43 1808 130 1 Fe 5 3 2 0 1 F dz2 6.632 3 2 0 44 1809 130 1 Fe 6 3 2 1 1 F dxz 6.632 3 2 0 45 1810 130 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 2 0 46 1811 130 1 Fe 8 3 2 -2 2 F dxy 2.565 3 2 0 47 1812 130 1 Fe 9 3 2 -1 2 F dyz 2.565 3 2 0 48 1813 130 1 Fe 10 3 2 0 2 F dz2 2.565 3 2 0 49 1814 130 1 Fe 11 3 2 1 2 F dxz 2.565 3 2 0 50 1815 130 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 2 0 51 1816 130 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 2 0 52 1817 130 1 Fe 14 4 1 0 1 T Ppz 9.649 3 2 0 53 1818 130 1 Fe 15 4 1 1 1 T Ppx 9.649 3 2 0 54 1819 131 1 Fe 1 4 0 0 1 F s 9.649 3 2 0 55 1820 131 1 Fe 2 4 0 0 2 F s 6.885 3 2 0 56 1821 131 1 Fe 3 3 2 -2 1 F dxy 6.632 3 2 0 57 1822 131 1 Fe 4 3 2 -1 1 F dyz 6.632 3 2 0 58 1823 131 1 Fe 5 3 2 0 1 F dz2 6.632 3 2 0 59 1824 131 1 Fe 6 3 2 1 1 F dxz 6.632 3 2 0 60 1825 131 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 2 0 61 1826 131 1 Fe 8 3 2 -2 2 F dxy 2.565 3 2 0 62 1827 131 1 Fe 9 3 2 -1 2 F dyz 2.565 3 2 0 63 1828 131 1 Fe 10 3 2 0 2 F dz2 2.565 3 2 0 64 1829 131 1 Fe 11 3 2 1 2 F dxz 2.565 3 2 0 65 1830 131 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 2 0 66 1831 131 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 2 0 67 1832 131 1 Fe 14 4 1 0 1 T Ppz 9.649 3 2 0 68 1833 131 1 Fe 15 4 1 1 1 T Ppx 9.649 3 2 0 69 1834 132 1 Fe 1 4 0 0 1 F s 9.649 3 2 0 70 1835 132 1 Fe 2 4 0 0 2 F s 6.885 3 2 0 71 1836 132 1 Fe 3 3 2 -2 1 F dxy 6.632 3 2 0 72 1837 132 1 Fe 4 3 2 -1 1 F dyz 6.632 3 2 0 73 1838 132 1 Fe 5 3 2 0 1 F dz2 6.632 3 2 0 74 1839 132 1 Fe 6 3 2 1 1 F dxz 6.632 3 2 0 75 1840 132 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 2 0 76 1841 132 1 Fe 8 3 2 -2 2 F dxy 2.565 3 2 0 77 1842 132 1 Fe 9 3 2 -1 2 F dyz 2.565 3 2 0 78 1843 132 1 Fe 10 3 2 0 2 F dz2 2.565 3 2 0 79 1844 132 1 Fe 11 3 2 1 2 F dxz 2.565 3 2 0 80 1845 132 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 2 0 81 1846 132 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 2 0 82 1847 132 1 Fe 14 4 1 0 1 T Ppz 9.649 3 2 0 83 1848 132 1 Fe 15 4 1 1 1 T Ppx 9.649 3 2 0 84 1849 133 3 Te 1 5 0 0 1 F s 6.195 4 2 0 1 1850 133 3 Te 2 5 0 0 2 F s 4.205 4 2 0 2 1851 133 3 Te 3 5 1 -1 1 F py 8.156 4 2 0 3 1852 133 3 Te 4 5 1 0 1 F pz 8.156 4 2 0 4 1853 133 3 Te 5 5 1 1 1 F px 8.156 4 2 0 5 1854 133 3 Te 6 5 1 -1 2 F py 5.009 4 2 0 6 1855 133 3 Te 7 5 1 0 2 F pz 5.009 4 2 0 7 1856 133 3 Te 8 5 1 1 2 F px 5.009 4 2 0 8 1857 133 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 2 0 9 1858 133 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 2 0 10 1859 133 3 Te 11 5 2 0 1 T Pdz2 8.156 4 2 0 11 1860 133 3 Te 12 5 2 1 1 T Pdxz 8.156 4 2 0 12 1861 133 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 2 0 13 1862 134 3 Te 1 5 0 0 1 F s 6.195 4 2 0 14 1863 134 3 Te 2 5 0 0 2 F s 4.205 4 2 0 15 1864 134 3 Te 3 5 1 -1 1 F py 8.156 4 2 0 16 1865 134 3 Te 4 5 1 0 1 F pz 8.156 4 2 0 17 1866 134 3 Te 5 5 1 1 1 F px 8.156 4 2 0 18 1867 134 3 Te 6 5 1 -1 2 F py 5.009 4 2 0 19 1868 134 3 Te 7 5 1 0 2 F pz 5.009 4 2 0 20 1869 134 3 Te 8 5 1 1 2 F px 5.009 4 2 0 21 1870 134 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 2 0 22 1871 134 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 2 0 23 1872 134 3 Te 11 5 2 0 1 T Pdz2 8.156 4 2 0 24 1873 134 3 Te 12 5 2 1 1 T Pdxz 8.156 4 2 0 25 1874 134 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 2 0 26 1875 135 2 Ge 1 4 0 0 1 F s 6.581 4 2 0 27 1876 135 2 Ge 2 4 0 0 2 F s 4.412 4 2 0 28 1877 135 2 Ge 3 4 1 -1 1 F py 9.340 4 2 0 29 1878 135 2 Ge 4 4 1 0 1 F pz 9.340 4 2 0 30 1879 135 2 Ge 5 4 1 1 1 F px 9.340 4 2 0 31 1880 135 2 Ge 6 4 1 -1 2 F py 5.665 4 2 0 32 1881 135 2 Ge 7 4 1 0 2 F pz 5.665 4 2 0 33 1882 135 2 Ge 8 4 1 1 2 F px 5.665 4 2 0 34 1883 135 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 2 0 35 1884 135 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 2 0 36 1885 135 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 2 0 37 1886 135 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 2 0 38 1887 135 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 2 0 39 1888 136 1 Fe 1 4 0 0 1 F s 9.649 4 2 0 40 1889 136 1 Fe 2 4 0 0 2 F s 6.885 4 2 0 41 1890 136 1 Fe 3 3 2 -2 1 F dxy 6.632 4 2 0 42 1891 136 1 Fe 4 3 2 -1 1 F dyz 6.632 4 2 0 43 1892 136 1 Fe 5 3 2 0 1 F dz2 6.632 4 2 0 44 1893 136 1 Fe 6 3 2 1 1 F dxz 6.632 4 2 0 45 1894 136 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 2 0 46 1895 136 1 Fe 8 3 2 -2 2 F dxy 2.565 4 2 0 47 1896 136 1 Fe 9 3 2 -1 2 F dyz 2.565 4 2 0 48 1897 136 1 Fe 10 3 2 0 2 F dz2 2.565 4 2 0 49 1898 136 1 Fe 11 3 2 1 2 F dxz 2.565 4 2 0 50 1899 136 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 2 0 51 1900 136 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 2 0 52 1901 136 1 Fe 14 4 1 0 1 T Ppz 9.649 4 2 0 53 1902 136 1 Fe 15 4 1 1 1 T Ppx 9.649 4 2 0 54 1903 137 1 Fe 1 4 0 0 1 F s 9.649 4 2 0 55 1904 137 1 Fe 2 4 0 0 2 F s 6.885 4 2 0 56 1905 137 1 Fe 3 3 2 -2 1 F dxy 6.632 4 2 0 57 1906 137 1 Fe 4 3 2 -1 1 F dyz 6.632 4 2 0 58 1907 137 1 Fe 5 3 2 0 1 F dz2 6.632 4 2 0 59 1908 137 1 Fe 6 3 2 1 1 F dxz 6.632 4 2 0 60 1909 137 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 2 0 61 1910 137 1 Fe 8 3 2 -2 2 F dxy 2.565 4 2 0 62 1911 137 1 Fe 9 3 2 -1 2 F dyz 2.565 4 2 0 63 1912 137 1 Fe 10 3 2 0 2 F dz2 2.565 4 2 0 64 1913 137 1 Fe 11 3 2 1 2 F dxz 2.565 4 2 0 65 1914 137 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 2 0 66 1915 137 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 2 0 67 1916 137 1 Fe 14 4 1 0 1 T Ppz 9.649 4 2 0 68 1917 137 1 Fe 15 4 1 1 1 T Ppx 9.649 4 2 0 69 1918 138 1 Fe 1 4 0 0 1 F s 9.649 4 2 0 70 1919 138 1 Fe 2 4 0 0 2 F s 6.885 4 2 0 71 1920 138 1 Fe 3 3 2 -2 1 F dxy 6.632 4 2 0 72 1921 138 1 Fe 4 3 2 -1 1 F dyz 6.632 4 2 0 73 1922 138 1 Fe 5 3 2 0 1 F dz2 6.632 4 2 0 74 1923 138 1 Fe 6 3 2 1 1 F dxz 6.632 4 2 0 75 1924 138 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 2 0 76 1925 138 1 Fe 8 3 2 -2 2 F dxy 2.565 4 2 0 77 1926 138 1 Fe 9 3 2 -1 2 F dyz 2.565 4 2 0 78 1927 138 1 Fe 10 3 2 0 2 F dz2 2.565 4 2 0 79 1928 138 1 Fe 11 3 2 1 2 F dxz 2.565 4 2 0 80 1929 138 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 2 0 81 1930 138 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 2 0 82 1931 138 1 Fe 14 4 1 0 1 T Ppz 9.649 4 2 0 83 1932 138 1 Fe 15 4 1 1 1 T Ppx 9.649 4 2 0 84 1933 139 3 Te 1 5 0 0 1 F s 6.195 -4 2 0 1 1934 139 3 Te 2 5 0 0 2 F s 4.205 -4 2 0 2 1935 139 3 Te 3 5 1 -1 1 F py 8.156 -4 2 0 3 1936 139 3 Te 4 5 1 0 1 F pz 8.156 -4 2 0 4 1937 139 3 Te 5 5 1 1 1 F px 8.156 -4 2 0 5 1938 139 3 Te 6 5 1 -1 2 F py 5.009 -4 2 0 6 1939 139 3 Te 7 5 1 0 2 F pz 5.009 -4 2 0 7 1940 139 3 Te 8 5 1 1 2 F px 5.009 -4 2 0 8 1941 139 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 2 0 9 1942 139 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 2 0 10 1943 139 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 2 0 11 1944 139 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 2 0 12 1945 139 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 2 0 13 1946 140 3 Te 1 5 0 0 1 F s 6.195 -4 2 0 14 1947 140 3 Te 2 5 0 0 2 F s 4.205 -4 2 0 15 1948 140 3 Te 3 5 1 -1 1 F py 8.156 -4 2 0 16 1949 140 3 Te 4 5 1 0 1 F pz 8.156 -4 2 0 17 1950 140 3 Te 5 5 1 1 1 F px 8.156 -4 2 0 18 1951 140 3 Te 6 5 1 -1 2 F py 5.009 -4 2 0 19 1952 140 3 Te 7 5 1 0 2 F pz 5.009 -4 2 0 20 1953 140 3 Te 8 5 1 1 2 F px 5.009 -4 2 0 21 1954 140 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 2 0 22 1955 140 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 2 0 23 1956 140 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 2 0 24 1957 140 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 2 0 25 1958 140 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 2 0 26 1959 141 2 Ge 1 4 0 0 1 F s 6.581 -4 2 0 27 1960 141 2 Ge 2 4 0 0 2 F s 4.412 -4 2 0 28 1961 141 2 Ge 3 4 1 -1 1 F py 9.340 -4 2 0 29 1962 141 2 Ge 4 4 1 0 1 F pz 9.340 -4 2 0 30 1963 141 2 Ge 5 4 1 1 1 F px 9.340 -4 2 0 31 1964 141 2 Ge 6 4 1 -1 2 F py 5.665 -4 2 0 32 1965 141 2 Ge 7 4 1 0 2 F pz 5.665 -4 2 0 33 1966 141 2 Ge 8 4 1 1 2 F px 5.665 -4 2 0 34 1967 141 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 2 0 35 1968 141 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 2 0 36 1969 141 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 2 0 37 1970 141 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 2 0 38 1971 141 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 2 0 39 1972 142 1 Fe 1 4 0 0 1 F s 9.649 -4 2 0 40 1973 142 1 Fe 2 4 0 0 2 F s 6.885 -4 2 0 41 1974 142 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 2 0 42 1975 142 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 2 0 43 1976 142 1 Fe 5 3 2 0 1 F dz2 6.632 -4 2 0 44 1977 142 1 Fe 6 3 2 1 1 F dxz 6.632 -4 2 0 45 1978 142 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 2 0 46 1979 142 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 2 0 47 1980 142 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 2 0 48 1981 142 1 Fe 10 3 2 0 2 F dz2 2.565 -4 2 0 49 1982 142 1 Fe 11 3 2 1 2 F dxz 2.565 -4 2 0 50 1983 142 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 2 0 51 1984 142 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 2 0 52 1985 142 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 2 0 53 1986 142 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 2 0 54 1987 143 1 Fe 1 4 0 0 1 F s 9.649 -4 2 0 55 1988 143 1 Fe 2 4 0 0 2 F s 6.885 -4 2 0 56 1989 143 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 2 0 57 1990 143 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 2 0 58 1991 143 1 Fe 5 3 2 0 1 F dz2 6.632 -4 2 0 59 1992 143 1 Fe 6 3 2 1 1 F dxz 6.632 -4 2 0 60 1993 143 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 2 0 61 1994 143 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 2 0 62 1995 143 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 2 0 63 1996 143 1 Fe 10 3 2 0 2 F dz2 2.565 -4 2 0 64 1997 143 1 Fe 11 3 2 1 2 F dxz 2.565 -4 2 0 65 1998 143 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 2 0 66 1999 143 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 2 0 67 2000 143 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 2 0 68 2001 143 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 2 0 69 2002 144 1 Fe 1 4 0 0 1 F s 9.649 -4 2 0 70 2003 144 1 Fe 2 4 0 0 2 F s 6.885 -4 2 0 71 2004 144 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 2 0 72 2005 144 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 2 0 73 2006 144 1 Fe 5 3 2 0 1 F dz2 6.632 -4 2 0 74 2007 144 1 Fe 6 3 2 1 1 F dxz 6.632 -4 2 0 75 2008 144 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 2 0 76 2009 144 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 2 0 77 2010 144 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 2 0 78 2011 144 1 Fe 10 3 2 0 2 F dz2 2.565 -4 2 0 79 2012 144 1 Fe 11 3 2 1 2 F dxz 2.565 -4 2 0 80 2013 144 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 2 0 81 2014 144 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 2 0 82 2015 144 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 2 0 83 2016 144 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 2 0 84 2017 145 3 Te 1 5 0 0 1 F s 6.195 -3 2 0 1 2018 145 3 Te 2 5 0 0 2 F s 4.205 -3 2 0 2 2019 145 3 Te 3 5 1 -1 1 F py 8.156 -3 2 0 3 2020 145 3 Te 4 5 1 0 1 F pz 8.156 -3 2 0 4 2021 145 3 Te 5 5 1 1 1 F px 8.156 -3 2 0 5 2022 145 3 Te 6 5 1 -1 2 F py 5.009 -3 2 0 6 2023 145 3 Te 7 5 1 0 2 F pz 5.009 -3 2 0 7 2024 145 3 Te 8 5 1 1 2 F px 5.009 -3 2 0 8 2025 145 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 2 0 9 2026 145 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 2 0 10 2027 145 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 2 0 11 2028 145 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 2 0 12 2029 145 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 2 0 13 2030 146 3 Te 1 5 0 0 1 F s 6.195 -3 2 0 14 2031 146 3 Te 2 5 0 0 2 F s 4.205 -3 2 0 15 2032 146 3 Te 3 5 1 -1 1 F py 8.156 -3 2 0 16 2033 146 3 Te 4 5 1 0 1 F pz 8.156 -3 2 0 17 2034 146 3 Te 5 5 1 1 1 F px 8.156 -3 2 0 18 2035 146 3 Te 6 5 1 -1 2 F py 5.009 -3 2 0 19 2036 146 3 Te 7 5 1 0 2 F pz 5.009 -3 2 0 20 2037 146 3 Te 8 5 1 1 2 F px 5.009 -3 2 0 21 2038 146 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 2 0 22 2039 146 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 2 0 23 2040 146 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 2 0 24 2041 146 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 2 0 25 2042 146 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 2 0 26 2043 147 2 Ge 1 4 0 0 1 F s 6.581 -3 2 0 27 2044 147 2 Ge 2 4 0 0 2 F s 4.412 -3 2 0 28 2045 147 2 Ge 3 4 1 -1 1 F py 9.340 -3 2 0 29 2046 147 2 Ge 4 4 1 0 1 F pz 9.340 -3 2 0 30 2047 147 2 Ge 5 4 1 1 1 F px 9.340 -3 2 0 31 2048 147 2 Ge 6 4 1 -1 2 F py 5.665 -3 2 0 32 2049 147 2 Ge 7 4 1 0 2 F pz 5.665 -3 2 0 33 2050 147 2 Ge 8 4 1 1 2 F px 5.665 -3 2 0 34 2051 147 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 2 0 35 2052 147 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 2 0 36 2053 147 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 2 0 37 2054 147 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 2 0 38 2055 147 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 2 0 39 2056 148 1 Fe 1 4 0 0 1 F s 9.649 -3 2 0 40 2057 148 1 Fe 2 4 0 0 2 F s 6.885 -3 2 0 41 2058 148 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 2 0 42 2059 148 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 2 0 43 2060 148 1 Fe 5 3 2 0 1 F dz2 6.632 -3 2 0 44 2061 148 1 Fe 6 3 2 1 1 F dxz 6.632 -3 2 0 45 2062 148 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 2 0 46 2063 148 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 2 0 47 2064 148 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 2 0 48 2065 148 1 Fe 10 3 2 0 2 F dz2 2.565 -3 2 0 49 2066 148 1 Fe 11 3 2 1 2 F dxz 2.565 -3 2 0 50 2067 148 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 2 0 51 2068 148 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 2 0 52 2069 148 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 2 0 53 2070 148 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 2 0 54 2071 149 1 Fe 1 4 0 0 1 F s 9.649 -3 2 0 55 2072 149 1 Fe 2 4 0 0 2 F s 6.885 -3 2 0 56 2073 149 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 2 0 57 2074 149 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 2 0 58 2075 149 1 Fe 5 3 2 0 1 F dz2 6.632 -3 2 0 59 2076 149 1 Fe 6 3 2 1 1 F dxz 6.632 -3 2 0 60 2077 149 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 2 0 61 2078 149 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 2 0 62 2079 149 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 2 0 63 2080 149 1 Fe 10 3 2 0 2 F dz2 2.565 -3 2 0 64 2081 149 1 Fe 11 3 2 1 2 F dxz 2.565 -3 2 0 65 2082 149 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 2 0 66 2083 149 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 2 0 67 2084 149 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 2 0 68 2085 149 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 2 0 69 2086 150 1 Fe 1 4 0 0 1 F s 9.649 -3 2 0 70 2087 150 1 Fe 2 4 0 0 2 F s 6.885 -3 2 0 71 2088 150 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 2 0 72 2089 150 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 2 0 73 2090 150 1 Fe 5 3 2 0 1 F dz2 6.632 -3 2 0 74 2091 150 1 Fe 6 3 2 1 1 F dxz 6.632 -3 2 0 75 2092 150 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 2 0 76 2093 150 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 2 0 77 2094 150 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 2 0 78 2095 150 1 Fe 10 3 2 0 2 F dz2 2.565 -3 2 0 79 2096 150 1 Fe 11 3 2 1 2 F dxz 2.565 -3 2 0 80 2097 150 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 2 0 81 2098 150 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 2 0 82 2099 150 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 2 0 83 2100 150 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 2 0 84 2101 151 3 Te 1 5 0 0 1 F s 6.195 -2 2 0 1 2102 151 3 Te 2 5 0 0 2 F s 4.205 -2 2 0 2 2103 151 3 Te 3 5 1 -1 1 F py 8.156 -2 2 0 3 2104 151 3 Te 4 5 1 0 1 F pz 8.156 -2 2 0 4 2105 151 3 Te 5 5 1 1 1 F px 8.156 -2 2 0 5 2106 151 3 Te 6 5 1 -1 2 F py 5.009 -2 2 0 6 2107 151 3 Te 7 5 1 0 2 F pz 5.009 -2 2 0 7 2108 151 3 Te 8 5 1 1 2 F px 5.009 -2 2 0 8 2109 151 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 2 0 9 2110 151 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 2 0 10 2111 151 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 2 0 11 2112 151 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 2 0 12 2113 151 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 2 0 13 2114 152 3 Te 1 5 0 0 1 F s 6.195 -2 2 0 14 2115 152 3 Te 2 5 0 0 2 F s 4.205 -2 2 0 15 2116 152 3 Te 3 5 1 -1 1 F py 8.156 -2 2 0 16 2117 152 3 Te 4 5 1 0 1 F pz 8.156 -2 2 0 17 2118 152 3 Te 5 5 1 1 1 F px 8.156 -2 2 0 18 2119 152 3 Te 6 5 1 -1 2 F py 5.009 -2 2 0 19 2120 152 3 Te 7 5 1 0 2 F pz 5.009 -2 2 0 20 2121 152 3 Te 8 5 1 1 2 F px 5.009 -2 2 0 21 2122 152 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 2 0 22 2123 152 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 2 0 23 2124 152 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 2 0 24 2125 152 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 2 0 25 2126 152 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 2 0 26 2127 153 2 Ge 1 4 0 0 1 F s 6.581 -2 2 0 27 2128 153 2 Ge 2 4 0 0 2 F s 4.412 -2 2 0 28 2129 153 2 Ge 3 4 1 -1 1 F py 9.340 -2 2 0 29 2130 153 2 Ge 4 4 1 0 1 F pz 9.340 -2 2 0 30 2131 153 2 Ge 5 4 1 1 1 F px 9.340 -2 2 0 31 2132 153 2 Ge 6 4 1 -1 2 F py 5.665 -2 2 0 32 2133 153 2 Ge 7 4 1 0 2 F pz 5.665 -2 2 0 33 2134 153 2 Ge 8 4 1 1 2 F px 5.665 -2 2 0 34 2135 153 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 2 0 35 2136 153 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 2 0 36 2137 153 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 2 0 37 2138 153 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 2 0 38 2139 153 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 2 0 39 2140 154 1 Fe 1 4 0 0 1 F s 9.649 -2 2 0 40 2141 154 1 Fe 2 4 0 0 2 F s 6.885 -2 2 0 41 2142 154 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 2 0 42 2143 154 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 2 0 43 2144 154 1 Fe 5 3 2 0 1 F dz2 6.632 -2 2 0 44 2145 154 1 Fe 6 3 2 1 1 F dxz 6.632 -2 2 0 45 2146 154 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 2 0 46 2147 154 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 2 0 47 2148 154 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 2 0 48 2149 154 1 Fe 10 3 2 0 2 F dz2 2.565 -2 2 0 49 2150 154 1 Fe 11 3 2 1 2 F dxz 2.565 -2 2 0 50 2151 154 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 2 0 51 2152 154 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 2 0 52 2153 154 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 2 0 53 2154 154 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 2 0 54 2155 155 1 Fe 1 4 0 0 1 F s 9.649 -2 2 0 55 2156 155 1 Fe 2 4 0 0 2 F s 6.885 -2 2 0 56 2157 155 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 2 0 57 2158 155 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 2 0 58 2159 155 1 Fe 5 3 2 0 1 F dz2 6.632 -2 2 0 59 2160 155 1 Fe 6 3 2 1 1 F dxz 6.632 -2 2 0 60 2161 155 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 2 0 61 2162 155 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 2 0 62 2163 155 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 2 0 63 2164 155 1 Fe 10 3 2 0 2 F dz2 2.565 -2 2 0 64 2165 155 1 Fe 11 3 2 1 2 F dxz 2.565 -2 2 0 65 2166 155 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 2 0 66 2167 155 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 2 0 67 2168 155 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 2 0 68 2169 155 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 2 0 69 2170 156 1 Fe 1 4 0 0 1 F s 9.649 -2 2 0 70 2171 156 1 Fe 2 4 0 0 2 F s 6.885 -2 2 0 71 2172 156 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 2 0 72 2173 156 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 2 0 73 2174 156 1 Fe 5 3 2 0 1 F dz2 6.632 -2 2 0 74 2175 156 1 Fe 6 3 2 1 1 F dxz 6.632 -2 2 0 75 2176 156 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 2 0 76 2177 156 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 2 0 77 2178 156 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 2 0 78 2179 156 1 Fe 10 3 2 0 2 F dz2 2.565 -2 2 0 79 2180 156 1 Fe 11 3 2 1 2 F dxz 2.565 -2 2 0 80 2181 156 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 2 0 81 2182 156 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 2 0 82 2183 156 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 2 0 83 2184 156 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 2 0 84 2185 157 3 Te 1 5 0 0 1 F s 6.195 -1 2 0 1 2186 157 3 Te 2 5 0 0 2 F s 4.205 -1 2 0 2 2187 157 3 Te 3 5 1 -1 1 F py 8.156 -1 2 0 3 2188 157 3 Te 4 5 1 0 1 F pz 8.156 -1 2 0 4 2189 157 3 Te 5 5 1 1 1 F px 8.156 -1 2 0 5 2190 157 3 Te 6 5 1 -1 2 F py 5.009 -1 2 0 6 2191 157 3 Te 7 5 1 0 2 F pz 5.009 -1 2 0 7 2192 157 3 Te 8 5 1 1 2 F px 5.009 -1 2 0 8 2193 157 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 2 0 9 2194 157 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 2 0 10 2195 157 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 2 0 11 2196 157 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 2 0 12 2197 157 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 2 0 13 2198 158 3 Te 1 5 0 0 1 F s 6.195 -1 2 0 14 2199 158 3 Te 2 5 0 0 2 F s 4.205 -1 2 0 15 2200 158 3 Te 3 5 1 -1 1 F py 8.156 -1 2 0 16 2201 158 3 Te 4 5 1 0 1 F pz 8.156 -1 2 0 17 2202 158 3 Te 5 5 1 1 1 F px 8.156 -1 2 0 18 2203 158 3 Te 6 5 1 -1 2 F py 5.009 -1 2 0 19 2204 158 3 Te 7 5 1 0 2 F pz 5.009 -1 2 0 20 2205 158 3 Te 8 5 1 1 2 F px 5.009 -1 2 0 21 2206 158 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 2 0 22 2207 158 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 2 0 23 2208 158 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 2 0 24 2209 158 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 2 0 25 2210 158 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 2 0 26 2211 159 2 Ge 1 4 0 0 1 F s 6.581 -1 2 0 27 2212 159 2 Ge 2 4 0 0 2 F s 4.412 -1 2 0 28 2213 159 2 Ge 3 4 1 -1 1 F py 9.340 -1 2 0 29 2214 159 2 Ge 4 4 1 0 1 F pz 9.340 -1 2 0 30 2215 159 2 Ge 5 4 1 1 1 F px 9.340 -1 2 0 31 2216 159 2 Ge 6 4 1 -1 2 F py 5.665 -1 2 0 32 2217 159 2 Ge 7 4 1 0 2 F pz 5.665 -1 2 0 33 2218 159 2 Ge 8 4 1 1 2 F px 5.665 -1 2 0 34 2219 159 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 2 0 35 2220 159 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 2 0 36 2221 159 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 2 0 37 2222 159 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 2 0 38 2223 159 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 2 0 39 2224 160 1 Fe 1 4 0 0 1 F s 9.649 -1 2 0 40 2225 160 1 Fe 2 4 0 0 2 F s 6.885 -1 2 0 41 2226 160 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 2 0 42 2227 160 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 2 0 43 2228 160 1 Fe 5 3 2 0 1 F dz2 6.632 -1 2 0 44 2229 160 1 Fe 6 3 2 1 1 F dxz 6.632 -1 2 0 45 2230 160 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 2 0 46 2231 160 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 2 0 47 2232 160 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 2 0 48 2233 160 1 Fe 10 3 2 0 2 F dz2 2.565 -1 2 0 49 2234 160 1 Fe 11 3 2 1 2 F dxz 2.565 -1 2 0 50 2235 160 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 2 0 51 2236 160 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 2 0 52 2237 160 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 2 0 53 2238 160 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 2 0 54 2239 161 1 Fe 1 4 0 0 1 F s 9.649 -1 2 0 55 2240 161 1 Fe 2 4 0 0 2 F s 6.885 -1 2 0 56 2241 161 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 2 0 57 2242 161 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 2 0 58 2243 161 1 Fe 5 3 2 0 1 F dz2 6.632 -1 2 0 59 2244 161 1 Fe 6 3 2 1 1 F dxz 6.632 -1 2 0 60 2245 161 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 2 0 61 2246 161 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 2 0 62 2247 161 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 2 0 63 2248 161 1 Fe 10 3 2 0 2 F dz2 2.565 -1 2 0 64 2249 161 1 Fe 11 3 2 1 2 F dxz 2.565 -1 2 0 65 2250 161 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 2 0 66 2251 161 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 2 0 67 2252 161 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 2 0 68 2253 161 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 2 0 69 2254 162 1 Fe 1 4 0 0 1 F s 9.649 -1 2 0 70 2255 162 1 Fe 2 4 0 0 2 F s 6.885 -1 2 0 71 2256 162 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 2 0 72 2257 162 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 2 0 73 2258 162 1 Fe 5 3 2 0 1 F dz2 6.632 -1 2 0 74 2259 162 1 Fe 6 3 2 1 1 F dxz 6.632 -1 2 0 75 2260 162 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 2 0 76 2261 162 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 2 0 77 2262 162 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 2 0 78 2263 162 1 Fe 10 3 2 0 2 F dz2 2.565 -1 2 0 79 2264 162 1 Fe 11 3 2 1 2 F dxz 2.565 -1 2 0 80 2265 162 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 2 0 81 2266 162 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 2 0 82 2267 162 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 2 0 83 2268 162 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 2 0 84 2269 163 3 Te 1 5 0 0 1 F s 6.195 0 3 0 1 2270 163 3 Te 2 5 0 0 2 F s 4.205 0 3 0 2 2271 163 3 Te 3 5 1 -1 1 F py 8.156 0 3 0 3 2272 163 3 Te 4 5 1 0 1 F pz 8.156 0 3 0 4 2273 163 3 Te 5 5 1 1 1 F px 8.156 0 3 0 5 2274 163 3 Te 6 5 1 -1 2 F py 5.009 0 3 0 6 2275 163 3 Te 7 5 1 0 2 F pz 5.009 0 3 0 7 2276 163 3 Te 8 5 1 1 2 F px 5.009 0 3 0 8 2277 163 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 3 0 9 2278 163 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 3 0 10 2279 163 3 Te 11 5 2 0 1 T Pdz2 8.156 0 3 0 11 2280 163 3 Te 12 5 2 1 1 T Pdxz 8.156 0 3 0 12 2281 163 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 3 0 13 2282 164 3 Te 1 5 0 0 1 F s 6.195 0 3 0 14 2283 164 3 Te 2 5 0 0 2 F s 4.205 0 3 0 15 2284 164 3 Te 3 5 1 -1 1 F py 8.156 0 3 0 16 2285 164 3 Te 4 5 1 0 1 F pz 8.156 0 3 0 17 2286 164 3 Te 5 5 1 1 1 F px 8.156 0 3 0 18 2287 164 3 Te 6 5 1 -1 2 F py 5.009 0 3 0 19 2288 164 3 Te 7 5 1 0 2 F pz 5.009 0 3 0 20 2289 164 3 Te 8 5 1 1 2 F px 5.009 0 3 0 21 2290 164 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 3 0 22 2291 164 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 3 0 23 2292 164 3 Te 11 5 2 0 1 T Pdz2 8.156 0 3 0 24 2293 164 3 Te 12 5 2 1 1 T Pdxz 8.156 0 3 0 25 2294 164 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 3 0 26 2295 165 2 Ge 1 4 0 0 1 F s 6.581 0 3 0 27 2296 165 2 Ge 2 4 0 0 2 F s 4.412 0 3 0 28 2297 165 2 Ge 3 4 1 -1 1 F py 9.340 0 3 0 29 2298 165 2 Ge 4 4 1 0 1 F pz 9.340 0 3 0 30 2299 165 2 Ge 5 4 1 1 1 F px 9.340 0 3 0 31 2300 165 2 Ge 6 4 1 -1 2 F py 5.665 0 3 0 32 2301 165 2 Ge 7 4 1 0 2 F pz 5.665 0 3 0 33 2302 165 2 Ge 8 4 1 1 2 F px 5.665 0 3 0 34 2303 165 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 3 0 35 2304 165 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 3 0 36 2305 165 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 3 0 37 2306 165 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 3 0 38 2307 165 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 3 0 39 2308 166 1 Fe 1 4 0 0 1 F s 9.649 0 3 0 40 2309 166 1 Fe 2 4 0 0 2 F s 6.885 0 3 0 41 2310 166 1 Fe 3 3 2 -2 1 F dxy 6.632 0 3 0 42 2311 166 1 Fe 4 3 2 -1 1 F dyz 6.632 0 3 0 43 2312 166 1 Fe 5 3 2 0 1 F dz2 6.632 0 3 0 44 2313 166 1 Fe 6 3 2 1 1 F dxz 6.632 0 3 0 45 2314 166 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 3 0 46 2315 166 1 Fe 8 3 2 -2 2 F dxy 2.565 0 3 0 47 2316 166 1 Fe 9 3 2 -1 2 F dyz 2.565 0 3 0 48 2317 166 1 Fe 10 3 2 0 2 F dz2 2.565 0 3 0 49 2318 166 1 Fe 11 3 2 1 2 F dxz 2.565 0 3 0 50 2319 166 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 3 0 51 2320 166 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 3 0 52 2321 166 1 Fe 14 4 1 0 1 T Ppz 9.649 0 3 0 53 2322 166 1 Fe 15 4 1 1 1 T Ppx 9.649 0 3 0 54 2323 167 1 Fe 1 4 0 0 1 F s 9.649 0 3 0 55 2324 167 1 Fe 2 4 0 0 2 F s 6.885 0 3 0 56 2325 167 1 Fe 3 3 2 -2 1 F dxy 6.632 0 3 0 57 2326 167 1 Fe 4 3 2 -1 1 F dyz 6.632 0 3 0 58 2327 167 1 Fe 5 3 2 0 1 F dz2 6.632 0 3 0 59 2328 167 1 Fe 6 3 2 1 1 F dxz 6.632 0 3 0 60 2329 167 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 3 0 61 2330 167 1 Fe 8 3 2 -2 2 F dxy 2.565 0 3 0 62 2331 167 1 Fe 9 3 2 -1 2 F dyz 2.565 0 3 0 63 2332 167 1 Fe 10 3 2 0 2 F dz2 2.565 0 3 0 64 2333 167 1 Fe 11 3 2 1 2 F dxz 2.565 0 3 0 65 2334 167 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 3 0 66 2335 167 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 3 0 67 2336 167 1 Fe 14 4 1 0 1 T Ppz 9.649 0 3 0 68 2337 167 1 Fe 15 4 1 1 1 T Ppx 9.649 0 3 0 69 2338 168 1 Fe 1 4 0 0 1 F s 9.649 0 3 0 70 2339 168 1 Fe 2 4 0 0 2 F s 6.885 0 3 0 71 2340 168 1 Fe 3 3 2 -2 1 F dxy 6.632 0 3 0 72 2341 168 1 Fe 4 3 2 -1 1 F dyz 6.632 0 3 0 73 2342 168 1 Fe 5 3 2 0 1 F dz2 6.632 0 3 0 74 2343 168 1 Fe 6 3 2 1 1 F dxz 6.632 0 3 0 75 2344 168 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 3 0 76 2345 168 1 Fe 8 3 2 -2 2 F dxy 2.565 0 3 0 77 2346 168 1 Fe 9 3 2 -1 2 F dyz 2.565 0 3 0 78 2347 168 1 Fe 10 3 2 0 2 F dz2 2.565 0 3 0 79 2348 168 1 Fe 11 3 2 1 2 F dxz 2.565 0 3 0 80 2349 168 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 3 0 81 2350 168 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 3 0 82 2351 168 1 Fe 14 4 1 0 1 T Ppz 9.649 0 3 0 83 2352 168 1 Fe 15 4 1 1 1 T Ppx 9.649 0 3 0 84 2353 169 3 Te 1 5 0 0 1 F s 6.195 1 3 0 1 2354 169 3 Te 2 5 0 0 2 F s 4.205 1 3 0 2 2355 169 3 Te 3 5 1 -1 1 F py 8.156 1 3 0 3 2356 169 3 Te 4 5 1 0 1 F pz 8.156 1 3 0 4 2357 169 3 Te 5 5 1 1 1 F px 8.156 1 3 0 5 2358 169 3 Te 6 5 1 -1 2 F py 5.009 1 3 0 6 2359 169 3 Te 7 5 1 0 2 F pz 5.009 1 3 0 7 2360 169 3 Te 8 5 1 1 2 F px 5.009 1 3 0 8 2361 169 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 3 0 9 2362 169 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 3 0 10 2363 169 3 Te 11 5 2 0 1 T Pdz2 8.156 1 3 0 11 2364 169 3 Te 12 5 2 1 1 T Pdxz 8.156 1 3 0 12 2365 169 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 3 0 13 2366 170 3 Te 1 5 0 0 1 F s 6.195 1 3 0 14 2367 170 3 Te 2 5 0 0 2 F s 4.205 1 3 0 15 2368 170 3 Te 3 5 1 -1 1 F py 8.156 1 3 0 16 2369 170 3 Te 4 5 1 0 1 F pz 8.156 1 3 0 17 2370 170 3 Te 5 5 1 1 1 F px 8.156 1 3 0 18 2371 170 3 Te 6 5 1 -1 2 F py 5.009 1 3 0 19 2372 170 3 Te 7 5 1 0 2 F pz 5.009 1 3 0 20 2373 170 3 Te 8 5 1 1 2 F px 5.009 1 3 0 21 2374 170 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 3 0 22 2375 170 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 3 0 23 2376 170 3 Te 11 5 2 0 1 T Pdz2 8.156 1 3 0 24 2377 170 3 Te 12 5 2 1 1 T Pdxz 8.156 1 3 0 25 2378 170 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 3 0 26 2379 171 2 Ge 1 4 0 0 1 F s 6.581 1 3 0 27 2380 171 2 Ge 2 4 0 0 2 F s 4.412 1 3 0 28 2381 171 2 Ge 3 4 1 -1 1 F py 9.340 1 3 0 29 2382 171 2 Ge 4 4 1 0 1 F pz 9.340 1 3 0 30 2383 171 2 Ge 5 4 1 1 1 F px 9.340 1 3 0 31 2384 171 2 Ge 6 4 1 -1 2 F py 5.665 1 3 0 32 2385 171 2 Ge 7 4 1 0 2 F pz 5.665 1 3 0 33 2386 171 2 Ge 8 4 1 1 2 F px 5.665 1 3 0 34 2387 171 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 3 0 35 2388 171 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 3 0 36 2389 171 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 3 0 37 2390 171 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 3 0 38 2391 171 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 3 0 39 2392 172 1 Fe 1 4 0 0 1 F s 9.649 1 3 0 40 2393 172 1 Fe 2 4 0 0 2 F s 6.885 1 3 0 41 2394 172 1 Fe 3 3 2 -2 1 F dxy 6.632 1 3 0 42 2395 172 1 Fe 4 3 2 -1 1 F dyz 6.632 1 3 0 43 2396 172 1 Fe 5 3 2 0 1 F dz2 6.632 1 3 0 44 2397 172 1 Fe 6 3 2 1 1 F dxz 6.632 1 3 0 45 2398 172 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 3 0 46 2399 172 1 Fe 8 3 2 -2 2 F dxy 2.565 1 3 0 47 2400 172 1 Fe 9 3 2 -1 2 F dyz 2.565 1 3 0 48 2401 172 1 Fe 10 3 2 0 2 F dz2 2.565 1 3 0 49 2402 172 1 Fe 11 3 2 1 2 F dxz 2.565 1 3 0 50 2403 172 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 3 0 51 2404 172 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 3 0 52 2405 172 1 Fe 14 4 1 0 1 T Ppz 9.649 1 3 0 53 2406 172 1 Fe 15 4 1 1 1 T Ppx 9.649 1 3 0 54 2407 173 1 Fe 1 4 0 0 1 F s 9.649 1 3 0 55 2408 173 1 Fe 2 4 0 0 2 F s 6.885 1 3 0 56 2409 173 1 Fe 3 3 2 -2 1 F dxy 6.632 1 3 0 57 2410 173 1 Fe 4 3 2 -1 1 F dyz 6.632 1 3 0 58 2411 173 1 Fe 5 3 2 0 1 F dz2 6.632 1 3 0 59 2412 173 1 Fe 6 3 2 1 1 F dxz 6.632 1 3 0 60 2413 173 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 3 0 61 2414 173 1 Fe 8 3 2 -2 2 F dxy 2.565 1 3 0 62 2415 173 1 Fe 9 3 2 -1 2 F dyz 2.565 1 3 0 63 2416 173 1 Fe 10 3 2 0 2 F dz2 2.565 1 3 0 64 2417 173 1 Fe 11 3 2 1 2 F dxz 2.565 1 3 0 65 2418 173 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 3 0 66 2419 173 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 3 0 67 2420 173 1 Fe 14 4 1 0 1 T Ppz 9.649 1 3 0 68 2421 173 1 Fe 15 4 1 1 1 T Ppx 9.649 1 3 0 69 2422 174 1 Fe 1 4 0 0 1 F s 9.649 1 3 0 70 2423 174 1 Fe 2 4 0 0 2 F s 6.885 1 3 0 71 2424 174 1 Fe 3 3 2 -2 1 F dxy 6.632 1 3 0 72 2425 174 1 Fe 4 3 2 -1 1 F dyz 6.632 1 3 0 73 2426 174 1 Fe 5 3 2 0 1 F dz2 6.632 1 3 0 74 2427 174 1 Fe 6 3 2 1 1 F dxz 6.632 1 3 0 75 2428 174 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 3 0 76 2429 174 1 Fe 8 3 2 -2 2 F dxy 2.565 1 3 0 77 2430 174 1 Fe 9 3 2 -1 2 F dyz 2.565 1 3 0 78 2431 174 1 Fe 10 3 2 0 2 F dz2 2.565 1 3 0 79 2432 174 1 Fe 11 3 2 1 2 F dxz 2.565 1 3 0 80 2433 174 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 3 0 81 2434 174 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 3 0 82 2435 174 1 Fe 14 4 1 0 1 T Ppz 9.649 1 3 0 83 2436 174 1 Fe 15 4 1 1 1 T Ppx 9.649 1 3 0 84 2437 175 3 Te 1 5 0 0 1 F s 6.195 2 3 0 1 2438 175 3 Te 2 5 0 0 2 F s 4.205 2 3 0 2 2439 175 3 Te 3 5 1 -1 1 F py 8.156 2 3 0 3 2440 175 3 Te 4 5 1 0 1 F pz 8.156 2 3 0 4 2441 175 3 Te 5 5 1 1 1 F px 8.156 2 3 0 5 2442 175 3 Te 6 5 1 -1 2 F py 5.009 2 3 0 6 2443 175 3 Te 7 5 1 0 2 F pz 5.009 2 3 0 7 2444 175 3 Te 8 5 1 1 2 F px 5.009 2 3 0 8 2445 175 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 3 0 9 2446 175 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 3 0 10 2447 175 3 Te 11 5 2 0 1 T Pdz2 8.156 2 3 0 11 2448 175 3 Te 12 5 2 1 1 T Pdxz 8.156 2 3 0 12 2449 175 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 3 0 13 2450 176 3 Te 1 5 0 0 1 F s 6.195 2 3 0 14 2451 176 3 Te 2 5 0 0 2 F s 4.205 2 3 0 15 2452 176 3 Te 3 5 1 -1 1 F py 8.156 2 3 0 16 2453 176 3 Te 4 5 1 0 1 F pz 8.156 2 3 0 17 2454 176 3 Te 5 5 1 1 1 F px 8.156 2 3 0 18 2455 176 3 Te 6 5 1 -1 2 F py 5.009 2 3 0 19 2456 176 3 Te 7 5 1 0 2 F pz 5.009 2 3 0 20 2457 176 3 Te 8 5 1 1 2 F px 5.009 2 3 0 21 2458 176 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 3 0 22 2459 176 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 3 0 23 2460 176 3 Te 11 5 2 0 1 T Pdz2 8.156 2 3 0 24 2461 176 3 Te 12 5 2 1 1 T Pdxz 8.156 2 3 0 25 2462 176 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 3 0 26 2463 177 2 Ge 1 4 0 0 1 F s 6.581 2 3 0 27 2464 177 2 Ge 2 4 0 0 2 F s 4.412 2 3 0 28 2465 177 2 Ge 3 4 1 -1 1 F py 9.340 2 3 0 29 2466 177 2 Ge 4 4 1 0 1 F pz 9.340 2 3 0 30 2467 177 2 Ge 5 4 1 1 1 F px 9.340 2 3 0 31 2468 177 2 Ge 6 4 1 -1 2 F py 5.665 2 3 0 32 2469 177 2 Ge 7 4 1 0 2 F pz 5.665 2 3 0 33 2470 177 2 Ge 8 4 1 1 2 F px 5.665 2 3 0 34 2471 177 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 3 0 35 2472 177 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 3 0 36 2473 177 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 3 0 37 2474 177 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 3 0 38 2475 177 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 3 0 39 2476 178 1 Fe 1 4 0 0 1 F s 9.649 2 3 0 40 2477 178 1 Fe 2 4 0 0 2 F s 6.885 2 3 0 41 2478 178 1 Fe 3 3 2 -2 1 F dxy 6.632 2 3 0 42 2479 178 1 Fe 4 3 2 -1 1 F dyz 6.632 2 3 0 43 2480 178 1 Fe 5 3 2 0 1 F dz2 6.632 2 3 0 44 2481 178 1 Fe 6 3 2 1 1 F dxz 6.632 2 3 0 45 2482 178 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 3 0 46 2483 178 1 Fe 8 3 2 -2 2 F dxy 2.565 2 3 0 47 2484 178 1 Fe 9 3 2 -1 2 F dyz 2.565 2 3 0 48 2485 178 1 Fe 10 3 2 0 2 F dz2 2.565 2 3 0 49 2486 178 1 Fe 11 3 2 1 2 F dxz 2.565 2 3 0 50 2487 178 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 3 0 51 2488 178 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 3 0 52 2489 178 1 Fe 14 4 1 0 1 T Ppz 9.649 2 3 0 53 2490 178 1 Fe 15 4 1 1 1 T Ppx 9.649 2 3 0 54 2491 179 1 Fe 1 4 0 0 1 F s 9.649 2 3 0 55 2492 179 1 Fe 2 4 0 0 2 F s 6.885 2 3 0 56 2493 179 1 Fe 3 3 2 -2 1 F dxy 6.632 2 3 0 57 2494 179 1 Fe 4 3 2 -1 1 F dyz 6.632 2 3 0 58 2495 179 1 Fe 5 3 2 0 1 F dz2 6.632 2 3 0 59 2496 179 1 Fe 6 3 2 1 1 F dxz 6.632 2 3 0 60 2497 179 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 3 0 61 2498 179 1 Fe 8 3 2 -2 2 F dxy 2.565 2 3 0 62 2499 179 1 Fe 9 3 2 -1 2 F dyz 2.565 2 3 0 63 2500 179 1 Fe 10 3 2 0 2 F dz2 2.565 2 3 0 64 2501 179 1 Fe 11 3 2 1 2 F dxz 2.565 2 3 0 65 2502 179 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 3 0 66 2503 179 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 3 0 67 2504 179 1 Fe 14 4 1 0 1 T Ppz 9.649 2 3 0 68 2505 179 1 Fe 15 4 1 1 1 T Ppx 9.649 2 3 0 69 2506 180 1 Fe 1 4 0 0 1 F s 9.649 2 3 0 70 2507 180 1 Fe 2 4 0 0 2 F s 6.885 2 3 0 71 2508 180 1 Fe 3 3 2 -2 1 F dxy 6.632 2 3 0 72 2509 180 1 Fe 4 3 2 -1 1 F dyz 6.632 2 3 0 73 2510 180 1 Fe 5 3 2 0 1 F dz2 6.632 2 3 0 74 2511 180 1 Fe 6 3 2 1 1 F dxz 6.632 2 3 0 75 2512 180 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 3 0 76 2513 180 1 Fe 8 3 2 -2 2 F dxy 2.565 2 3 0 77 2514 180 1 Fe 9 3 2 -1 2 F dyz 2.565 2 3 0 78 2515 180 1 Fe 10 3 2 0 2 F dz2 2.565 2 3 0 79 2516 180 1 Fe 11 3 2 1 2 F dxz 2.565 2 3 0 80 2517 180 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 3 0 81 2518 180 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 3 0 82 2519 180 1 Fe 14 4 1 0 1 T Ppz 9.649 2 3 0 83 2520 180 1 Fe 15 4 1 1 1 T Ppx 9.649 2 3 0 84 2521 181 3 Te 1 5 0 0 1 F s 6.195 3 3 0 1 2522 181 3 Te 2 5 0 0 2 F s 4.205 3 3 0 2 2523 181 3 Te 3 5 1 -1 1 F py 8.156 3 3 0 3 2524 181 3 Te 4 5 1 0 1 F pz 8.156 3 3 0 4 2525 181 3 Te 5 5 1 1 1 F px 8.156 3 3 0 5 2526 181 3 Te 6 5 1 -1 2 F py 5.009 3 3 0 6 2527 181 3 Te 7 5 1 0 2 F pz 5.009 3 3 0 7 2528 181 3 Te 8 5 1 1 2 F px 5.009 3 3 0 8 2529 181 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 3 0 9 2530 181 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 3 0 10 2531 181 3 Te 11 5 2 0 1 T Pdz2 8.156 3 3 0 11 2532 181 3 Te 12 5 2 1 1 T Pdxz 8.156 3 3 0 12 2533 181 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 3 0 13 2534 182 3 Te 1 5 0 0 1 F s 6.195 3 3 0 14 2535 182 3 Te 2 5 0 0 2 F s 4.205 3 3 0 15 2536 182 3 Te 3 5 1 -1 1 F py 8.156 3 3 0 16 2537 182 3 Te 4 5 1 0 1 F pz 8.156 3 3 0 17 2538 182 3 Te 5 5 1 1 1 F px 8.156 3 3 0 18 2539 182 3 Te 6 5 1 -1 2 F py 5.009 3 3 0 19 2540 182 3 Te 7 5 1 0 2 F pz 5.009 3 3 0 20 2541 182 3 Te 8 5 1 1 2 F px 5.009 3 3 0 21 2542 182 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 3 0 22 2543 182 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 3 0 23 2544 182 3 Te 11 5 2 0 1 T Pdz2 8.156 3 3 0 24 2545 182 3 Te 12 5 2 1 1 T Pdxz 8.156 3 3 0 25 2546 182 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 3 0 26 2547 183 2 Ge 1 4 0 0 1 F s 6.581 3 3 0 27 2548 183 2 Ge 2 4 0 0 2 F s 4.412 3 3 0 28 2549 183 2 Ge 3 4 1 -1 1 F py 9.340 3 3 0 29 2550 183 2 Ge 4 4 1 0 1 F pz 9.340 3 3 0 30 2551 183 2 Ge 5 4 1 1 1 F px 9.340 3 3 0 31 2552 183 2 Ge 6 4 1 -1 2 F py 5.665 3 3 0 32 2553 183 2 Ge 7 4 1 0 2 F pz 5.665 3 3 0 33 2554 183 2 Ge 8 4 1 1 2 F px 5.665 3 3 0 34 2555 183 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 3 0 35 2556 183 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 3 0 36 2557 183 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 3 0 37 2558 183 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 3 0 38 2559 183 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 3 0 39 2560 184 1 Fe 1 4 0 0 1 F s 9.649 3 3 0 40 2561 184 1 Fe 2 4 0 0 2 F s 6.885 3 3 0 41 2562 184 1 Fe 3 3 2 -2 1 F dxy 6.632 3 3 0 42 2563 184 1 Fe 4 3 2 -1 1 F dyz 6.632 3 3 0 43 2564 184 1 Fe 5 3 2 0 1 F dz2 6.632 3 3 0 44 2565 184 1 Fe 6 3 2 1 1 F dxz 6.632 3 3 0 45 2566 184 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 3 0 46 2567 184 1 Fe 8 3 2 -2 2 F dxy 2.565 3 3 0 47 2568 184 1 Fe 9 3 2 -1 2 F dyz 2.565 3 3 0 48 2569 184 1 Fe 10 3 2 0 2 F dz2 2.565 3 3 0 49 2570 184 1 Fe 11 3 2 1 2 F dxz 2.565 3 3 0 50 2571 184 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 3 0 51 2572 184 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 3 0 52 2573 184 1 Fe 14 4 1 0 1 T Ppz 9.649 3 3 0 53 2574 184 1 Fe 15 4 1 1 1 T Ppx 9.649 3 3 0 54 2575 185 1 Fe 1 4 0 0 1 F s 9.649 3 3 0 55 2576 185 1 Fe 2 4 0 0 2 F s 6.885 3 3 0 56 2577 185 1 Fe 3 3 2 -2 1 F dxy 6.632 3 3 0 57 2578 185 1 Fe 4 3 2 -1 1 F dyz 6.632 3 3 0 58 2579 185 1 Fe 5 3 2 0 1 F dz2 6.632 3 3 0 59 2580 185 1 Fe 6 3 2 1 1 F dxz 6.632 3 3 0 60 2581 185 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 3 0 61 2582 185 1 Fe 8 3 2 -2 2 F dxy 2.565 3 3 0 62 2583 185 1 Fe 9 3 2 -1 2 F dyz 2.565 3 3 0 63 2584 185 1 Fe 10 3 2 0 2 F dz2 2.565 3 3 0 64 2585 185 1 Fe 11 3 2 1 2 F dxz 2.565 3 3 0 65 2586 185 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 3 0 66 2587 185 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 3 0 67 2588 185 1 Fe 14 4 1 0 1 T Ppz 9.649 3 3 0 68 2589 185 1 Fe 15 4 1 1 1 T Ppx 9.649 3 3 0 69 2590 186 1 Fe 1 4 0 0 1 F s 9.649 3 3 0 70 2591 186 1 Fe 2 4 0 0 2 F s 6.885 3 3 0 71 2592 186 1 Fe 3 3 2 -2 1 F dxy 6.632 3 3 0 72 2593 186 1 Fe 4 3 2 -1 1 F dyz 6.632 3 3 0 73 2594 186 1 Fe 5 3 2 0 1 F dz2 6.632 3 3 0 74 2595 186 1 Fe 6 3 2 1 1 F dxz 6.632 3 3 0 75 2596 186 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 3 0 76 2597 186 1 Fe 8 3 2 -2 2 F dxy 2.565 3 3 0 77 2598 186 1 Fe 9 3 2 -1 2 F dyz 2.565 3 3 0 78 2599 186 1 Fe 10 3 2 0 2 F dz2 2.565 3 3 0 79 2600 186 1 Fe 11 3 2 1 2 F dxz 2.565 3 3 0 80 2601 186 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 3 0 81 2602 186 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 3 0 82 2603 186 1 Fe 14 4 1 0 1 T Ppz 9.649 3 3 0 83 2604 186 1 Fe 15 4 1 1 1 T Ppx 9.649 3 3 0 84 2605 187 3 Te 1 5 0 0 1 F s 6.195 4 3 0 1 2606 187 3 Te 2 5 0 0 2 F s 4.205 4 3 0 2 2607 187 3 Te 3 5 1 -1 1 F py 8.156 4 3 0 3 2608 187 3 Te 4 5 1 0 1 F pz 8.156 4 3 0 4 2609 187 3 Te 5 5 1 1 1 F px 8.156 4 3 0 5 2610 187 3 Te 6 5 1 -1 2 F py 5.009 4 3 0 6 2611 187 3 Te 7 5 1 0 2 F pz 5.009 4 3 0 7 2612 187 3 Te 8 5 1 1 2 F px 5.009 4 3 0 8 2613 187 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 3 0 9 2614 187 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 3 0 10 2615 187 3 Te 11 5 2 0 1 T Pdz2 8.156 4 3 0 11 2616 187 3 Te 12 5 2 1 1 T Pdxz 8.156 4 3 0 12 2617 187 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 3 0 13 2618 188 3 Te 1 5 0 0 1 F s 6.195 4 3 0 14 2619 188 3 Te 2 5 0 0 2 F s 4.205 4 3 0 15 2620 188 3 Te 3 5 1 -1 1 F py 8.156 4 3 0 16 2621 188 3 Te 4 5 1 0 1 F pz 8.156 4 3 0 17 2622 188 3 Te 5 5 1 1 1 F px 8.156 4 3 0 18 2623 188 3 Te 6 5 1 -1 2 F py 5.009 4 3 0 19 2624 188 3 Te 7 5 1 0 2 F pz 5.009 4 3 0 20 2625 188 3 Te 8 5 1 1 2 F px 5.009 4 3 0 21 2626 188 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 3 0 22 2627 188 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 3 0 23 2628 188 3 Te 11 5 2 0 1 T Pdz2 8.156 4 3 0 24 2629 188 3 Te 12 5 2 1 1 T Pdxz 8.156 4 3 0 25 2630 188 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 3 0 26 2631 189 2 Ge 1 4 0 0 1 F s 6.581 4 3 0 27 2632 189 2 Ge 2 4 0 0 2 F s 4.412 4 3 0 28 2633 189 2 Ge 3 4 1 -1 1 F py 9.340 4 3 0 29 2634 189 2 Ge 4 4 1 0 1 F pz 9.340 4 3 0 30 2635 189 2 Ge 5 4 1 1 1 F px 9.340 4 3 0 31 2636 189 2 Ge 6 4 1 -1 2 F py 5.665 4 3 0 32 2637 189 2 Ge 7 4 1 0 2 F pz 5.665 4 3 0 33 2638 189 2 Ge 8 4 1 1 2 F px 5.665 4 3 0 34 2639 189 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 3 0 35 2640 189 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 3 0 36 2641 189 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 3 0 37 2642 189 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 3 0 38 2643 189 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 3 0 39 2644 190 1 Fe 1 4 0 0 1 F s 9.649 4 3 0 40 2645 190 1 Fe 2 4 0 0 2 F s 6.885 4 3 0 41 2646 190 1 Fe 3 3 2 -2 1 F dxy 6.632 4 3 0 42 2647 190 1 Fe 4 3 2 -1 1 F dyz 6.632 4 3 0 43 2648 190 1 Fe 5 3 2 0 1 F dz2 6.632 4 3 0 44 2649 190 1 Fe 6 3 2 1 1 F dxz 6.632 4 3 0 45 2650 190 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 3 0 46 2651 190 1 Fe 8 3 2 -2 2 F dxy 2.565 4 3 0 47 2652 190 1 Fe 9 3 2 -1 2 F dyz 2.565 4 3 0 48 2653 190 1 Fe 10 3 2 0 2 F dz2 2.565 4 3 0 49 2654 190 1 Fe 11 3 2 1 2 F dxz 2.565 4 3 0 50 2655 190 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 3 0 51 2656 190 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 3 0 52 2657 190 1 Fe 14 4 1 0 1 T Ppz 9.649 4 3 0 53 2658 190 1 Fe 15 4 1 1 1 T Ppx 9.649 4 3 0 54 2659 191 1 Fe 1 4 0 0 1 F s 9.649 4 3 0 55 2660 191 1 Fe 2 4 0 0 2 F s 6.885 4 3 0 56 2661 191 1 Fe 3 3 2 -2 1 F dxy 6.632 4 3 0 57 2662 191 1 Fe 4 3 2 -1 1 F dyz 6.632 4 3 0 58 2663 191 1 Fe 5 3 2 0 1 F dz2 6.632 4 3 0 59 2664 191 1 Fe 6 3 2 1 1 F dxz 6.632 4 3 0 60 2665 191 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 3 0 61 2666 191 1 Fe 8 3 2 -2 2 F dxy 2.565 4 3 0 62 2667 191 1 Fe 9 3 2 -1 2 F dyz 2.565 4 3 0 63 2668 191 1 Fe 10 3 2 0 2 F dz2 2.565 4 3 0 64 2669 191 1 Fe 11 3 2 1 2 F dxz 2.565 4 3 0 65 2670 191 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 3 0 66 2671 191 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 3 0 67 2672 191 1 Fe 14 4 1 0 1 T Ppz 9.649 4 3 0 68 2673 191 1 Fe 15 4 1 1 1 T Ppx 9.649 4 3 0 69 2674 192 1 Fe 1 4 0 0 1 F s 9.649 4 3 0 70 2675 192 1 Fe 2 4 0 0 2 F s 6.885 4 3 0 71 2676 192 1 Fe 3 3 2 -2 1 F dxy 6.632 4 3 0 72 2677 192 1 Fe 4 3 2 -1 1 F dyz 6.632 4 3 0 73 2678 192 1 Fe 5 3 2 0 1 F dz2 6.632 4 3 0 74 2679 192 1 Fe 6 3 2 1 1 F dxz 6.632 4 3 0 75 2680 192 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 3 0 76 2681 192 1 Fe 8 3 2 -2 2 F dxy 2.565 4 3 0 77 2682 192 1 Fe 9 3 2 -1 2 F dyz 2.565 4 3 0 78 2683 192 1 Fe 10 3 2 0 2 F dz2 2.565 4 3 0 79 2684 192 1 Fe 11 3 2 1 2 F dxz 2.565 4 3 0 80 2685 192 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 3 0 81 2686 192 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 3 0 82 2687 192 1 Fe 14 4 1 0 1 T Ppz 9.649 4 3 0 83 2688 192 1 Fe 15 4 1 1 1 T Ppx 9.649 4 3 0 84 2689 193 3 Te 1 5 0 0 1 F s 6.195 -4 3 0 1 2690 193 3 Te 2 5 0 0 2 F s 4.205 -4 3 0 2 2691 193 3 Te 3 5 1 -1 1 F py 8.156 -4 3 0 3 2692 193 3 Te 4 5 1 0 1 F pz 8.156 -4 3 0 4 2693 193 3 Te 5 5 1 1 1 F px 8.156 -4 3 0 5 2694 193 3 Te 6 5 1 -1 2 F py 5.009 -4 3 0 6 2695 193 3 Te 7 5 1 0 2 F pz 5.009 -4 3 0 7 2696 193 3 Te 8 5 1 1 2 F px 5.009 -4 3 0 8 2697 193 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 3 0 9 2698 193 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 3 0 10 2699 193 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 3 0 11 2700 193 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 3 0 12 2701 193 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 3 0 13 2702 194 3 Te 1 5 0 0 1 F s 6.195 -4 3 0 14 2703 194 3 Te 2 5 0 0 2 F s 4.205 -4 3 0 15 2704 194 3 Te 3 5 1 -1 1 F py 8.156 -4 3 0 16 2705 194 3 Te 4 5 1 0 1 F pz 8.156 -4 3 0 17 2706 194 3 Te 5 5 1 1 1 F px 8.156 -4 3 0 18 2707 194 3 Te 6 5 1 -1 2 F py 5.009 -4 3 0 19 2708 194 3 Te 7 5 1 0 2 F pz 5.009 -4 3 0 20 2709 194 3 Te 8 5 1 1 2 F px 5.009 -4 3 0 21 2710 194 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 3 0 22 2711 194 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 3 0 23 2712 194 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 3 0 24 2713 194 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 3 0 25 2714 194 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 3 0 26 2715 195 2 Ge 1 4 0 0 1 F s 6.581 -4 3 0 27 2716 195 2 Ge 2 4 0 0 2 F s 4.412 -4 3 0 28 2717 195 2 Ge 3 4 1 -1 1 F py 9.340 -4 3 0 29 2718 195 2 Ge 4 4 1 0 1 F pz 9.340 -4 3 0 30 2719 195 2 Ge 5 4 1 1 1 F px 9.340 -4 3 0 31 2720 195 2 Ge 6 4 1 -1 2 F py 5.665 -4 3 0 32 2721 195 2 Ge 7 4 1 0 2 F pz 5.665 -4 3 0 33 2722 195 2 Ge 8 4 1 1 2 F px 5.665 -4 3 0 34 2723 195 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 3 0 35 2724 195 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 3 0 36 2725 195 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 3 0 37 2726 195 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 3 0 38 2727 195 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 3 0 39 2728 196 1 Fe 1 4 0 0 1 F s 9.649 -4 3 0 40 2729 196 1 Fe 2 4 0 0 2 F s 6.885 -4 3 0 41 2730 196 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 3 0 42 2731 196 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 3 0 43 2732 196 1 Fe 5 3 2 0 1 F dz2 6.632 -4 3 0 44 2733 196 1 Fe 6 3 2 1 1 F dxz 6.632 -4 3 0 45 2734 196 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 3 0 46 2735 196 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 3 0 47 2736 196 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 3 0 48 2737 196 1 Fe 10 3 2 0 2 F dz2 2.565 -4 3 0 49 2738 196 1 Fe 11 3 2 1 2 F dxz 2.565 -4 3 0 50 2739 196 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 3 0 51 2740 196 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 3 0 52 2741 196 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 3 0 53 2742 196 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 3 0 54 2743 197 1 Fe 1 4 0 0 1 F s 9.649 -4 3 0 55 2744 197 1 Fe 2 4 0 0 2 F s 6.885 -4 3 0 56 2745 197 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 3 0 57 2746 197 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 3 0 58 2747 197 1 Fe 5 3 2 0 1 F dz2 6.632 -4 3 0 59 2748 197 1 Fe 6 3 2 1 1 F dxz 6.632 -4 3 0 60 2749 197 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 3 0 61 2750 197 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 3 0 62 2751 197 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 3 0 63 2752 197 1 Fe 10 3 2 0 2 F dz2 2.565 -4 3 0 64 2753 197 1 Fe 11 3 2 1 2 F dxz 2.565 -4 3 0 65 2754 197 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 3 0 66 2755 197 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 3 0 67 2756 197 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 3 0 68 2757 197 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 3 0 69 2758 198 1 Fe 1 4 0 0 1 F s 9.649 -4 3 0 70 2759 198 1 Fe 2 4 0 0 2 F s 6.885 -4 3 0 71 2760 198 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 3 0 72 2761 198 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 3 0 73 2762 198 1 Fe 5 3 2 0 1 F dz2 6.632 -4 3 0 74 2763 198 1 Fe 6 3 2 1 1 F dxz 6.632 -4 3 0 75 2764 198 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 3 0 76 2765 198 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 3 0 77 2766 198 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 3 0 78 2767 198 1 Fe 10 3 2 0 2 F dz2 2.565 -4 3 0 79 2768 198 1 Fe 11 3 2 1 2 F dxz 2.565 -4 3 0 80 2769 198 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 3 0 81 2770 198 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 3 0 82 2771 198 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 3 0 83 2772 198 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 3 0 84 2773 199 3 Te 1 5 0 0 1 F s 6.195 -3 3 0 1 2774 199 3 Te 2 5 0 0 2 F s 4.205 -3 3 0 2 2775 199 3 Te 3 5 1 -1 1 F py 8.156 -3 3 0 3 2776 199 3 Te 4 5 1 0 1 F pz 8.156 -3 3 0 4 2777 199 3 Te 5 5 1 1 1 F px 8.156 -3 3 0 5 2778 199 3 Te 6 5 1 -1 2 F py 5.009 -3 3 0 6 2779 199 3 Te 7 5 1 0 2 F pz 5.009 -3 3 0 7 2780 199 3 Te 8 5 1 1 2 F px 5.009 -3 3 0 8 2781 199 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 3 0 9 2782 199 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 3 0 10 2783 199 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 3 0 11 2784 199 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 3 0 12 2785 199 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 3 0 13 2786 200 3 Te 1 5 0 0 1 F s 6.195 -3 3 0 14 2787 200 3 Te 2 5 0 0 2 F s 4.205 -3 3 0 15 2788 200 3 Te 3 5 1 -1 1 F py 8.156 -3 3 0 16 2789 200 3 Te 4 5 1 0 1 F pz 8.156 -3 3 0 17 2790 200 3 Te 5 5 1 1 1 F px 8.156 -3 3 0 18 2791 200 3 Te 6 5 1 -1 2 F py 5.009 -3 3 0 19 2792 200 3 Te 7 5 1 0 2 F pz 5.009 -3 3 0 20 2793 200 3 Te 8 5 1 1 2 F px 5.009 -3 3 0 21 2794 200 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 3 0 22 2795 200 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 3 0 23 2796 200 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 3 0 24 2797 200 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 3 0 25 2798 200 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 3 0 26 2799 201 2 Ge 1 4 0 0 1 F s 6.581 -3 3 0 27 2800 201 2 Ge 2 4 0 0 2 F s 4.412 -3 3 0 28 2801 201 2 Ge 3 4 1 -1 1 F py 9.340 -3 3 0 29 2802 201 2 Ge 4 4 1 0 1 F pz 9.340 -3 3 0 30 2803 201 2 Ge 5 4 1 1 1 F px 9.340 -3 3 0 31 2804 201 2 Ge 6 4 1 -1 2 F py 5.665 -3 3 0 32 2805 201 2 Ge 7 4 1 0 2 F pz 5.665 -3 3 0 33 2806 201 2 Ge 8 4 1 1 2 F px 5.665 -3 3 0 34 2807 201 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 3 0 35 2808 201 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 3 0 36 2809 201 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 3 0 37 2810 201 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 3 0 38 2811 201 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 3 0 39 2812 202 1 Fe 1 4 0 0 1 F s 9.649 -3 3 0 40 2813 202 1 Fe 2 4 0 0 2 F s 6.885 -3 3 0 41 2814 202 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 3 0 42 2815 202 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 3 0 43 2816 202 1 Fe 5 3 2 0 1 F dz2 6.632 -3 3 0 44 2817 202 1 Fe 6 3 2 1 1 F dxz 6.632 -3 3 0 45 2818 202 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 3 0 46 2819 202 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 3 0 47 2820 202 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 3 0 48 2821 202 1 Fe 10 3 2 0 2 F dz2 2.565 -3 3 0 49 2822 202 1 Fe 11 3 2 1 2 F dxz 2.565 -3 3 0 50 2823 202 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 3 0 51 2824 202 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 3 0 52 2825 202 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 3 0 53 2826 202 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 3 0 54 2827 203 1 Fe 1 4 0 0 1 F s 9.649 -3 3 0 55 2828 203 1 Fe 2 4 0 0 2 F s 6.885 -3 3 0 56 2829 203 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 3 0 57 2830 203 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 3 0 58 2831 203 1 Fe 5 3 2 0 1 F dz2 6.632 -3 3 0 59 2832 203 1 Fe 6 3 2 1 1 F dxz 6.632 -3 3 0 60 2833 203 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 3 0 61 2834 203 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 3 0 62 2835 203 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 3 0 63 2836 203 1 Fe 10 3 2 0 2 F dz2 2.565 -3 3 0 64 2837 203 1 Fe 11 3 2 1 2 F dxz 2.565 -3 3 0 65 2838 203 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 3 0 66 2839 203 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 3 0 67 2840 203 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 3 0 68 2841 203 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 3 0 69 2842 204 1 Fe 1 4 0 0 1 F s 9.649 -3 3 0 70 2843 204 1 Fe 2 4 0 0 2 F s 6.885 -3 3 0 71 2844 204 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 3 0 72 2845 204 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 3 0 73 2846 204 1 Fe 5 3 2 0 1 F dz2 6.632 -3 3 0 74 2847 204 1 Fe 6 3 2 1 1 F dxz 6.632 -3 3 0 75 2848 204 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 3 0 76 2849 204 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 3 0 77 2850 204 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 3 0 78 2851 204 1 Fe 10 3 2 0 2 F dz2 2.565 -3 3 0 79 2852 204 1 Fe 11 3 2 1 2 F dxz 2.565 -3 3 0 80 2853 204 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 3 0 81 2854 204 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 3 0 82 2855 204 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 3 0 83 2856 204 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 3 0 84 2857 205 3 Te 1 5 0 0 1 F s 6.195 -2 3 0 1 2858 205 3 Te 2 5 0 0 2 F s 4.205 -2 3 0 2 2859 205 3 Te 3 5 1 -1 1 F py 8.156 -2 3 0 3 2860 205 3 Te 4 5 1 0 1 F pz 8.156 -2 3 0 4 2861 205 3 Te 5 5 1 1 1 F px 8.156 -2 3 0 5 2862 205 3 Te 6 5 1 -1 2 F py 5.009 -2 3 0 6 2863 205 3 Te 7 5 1 0 2 F pz 5.009 -2 3 0 7 2864 205 3 Te 8 5 1 1 2 F px 5.009 -2 3 0 8 2865 205 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 3 0 9 2866 205 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 3 0 10 2867 205 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 3 0 11 2868 205 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 3 0 12 2869 205 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 3 0 13 2870 206 3 Te 1 5 0 0 1 F s 6.195 -2 3 0 14 2871 206 3 Te 2 5 0 0 2 F s 4.205 -2 3 0 15 2872 206 3 Te 3 5 1 -1 1 F py 8.156 -2 3 0 16 2873 206 3 Te 4 5 1 0 1 F pz 8.156 -2 3 0 17 2874 206 3 Te 5 5 1 1 1 F px 8.156 -2 3 0 18 2875 206 3 Te 6 5 1 -1 2 F py 5.009 -2 3 0 19 2876 206 3 Te 7 5 1 0 2 F pz 5.009 -2 3 0 20 2877 206 3 Te 8 5 1 1 2 F px 5.009 -2 3 0 21 2878 206 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 3 0 22 2879 206 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 3 0 23 2880 206 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 3 0 24 2881 206 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 3 0 25 2882 206 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 3 0 26 2883 207 2 Ge 1 4 0 0 1 F s 6.581 -2 3 0 27 2884 207 2 Ge 2 4 0 0 2 F s 4.412 -2 3 0 28 2885 207 2 Ge 3 4 1 -1 1 F py 9.340 -2 3 0 29 2886 207 2 Ge 4 4 1 0 1 F pz 9.340 -2 3 0 30 2887 207 2 Ge 5 4 1 1 1 F px 9.340 -2 3 0 31 2888 207 2 Ge 6 4 1 -1 2 F py 5.665 -2 3 0 32 2889 207 2 Ge 7 4 1 0 2 F pz 5.665 -2 3 0 33 2890 207 2 Ge 8 4 1 1 2 F px 5.665 -2 3 0 34 2891 207 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 3 0 35 2892 207 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 3 0 36 2893 207 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 3 0 37 2894 207 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 3 0 38 2895 207 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 3 0 39 2896 208 1 Fe 1 4 0 0 1 F s 9.649 -2 3 0 40 2897 208 1 Fe 2 4 0 0 2 F s 6.885 -2 3 0 41 2898 208 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 3 0 42 2899 208 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 3 0 43 2900 208 1 Fe 5 3 2 0 1 F dz2 6.632 -2 3 0 44 2901 208 1 Fe 6 3 2 1 1 F dxz 6.632 -2 3 0 45 2902 208 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 3 0 46 2903 208 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 3 0 47 2904 208 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 3 0 48 2905 208 1 Fe 10 3 2 0 2 F dz2 2.565 -2 3 0 49 2906 208 1 Fe 11 3 2 1 2 F dxz 2.565 -2 3 0 50 2907 208 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 3 0 51 2908 208 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 3 0 52 2909 208 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 3 0 53 2910 208 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 3 0 54 2911 209 1 Fe 1 4 0 0 1 F s 9.649 -2 3 0 55 2912 209 1 Fe 2 4 0 0 2 F s 6.885 -2 3 0 56 2913 209 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 3 0 57 2914 209 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 3 0 58 2915 209 1 Fe 5 3 2 0 1 F dz2 6.632 -2 3 0 59 2916 209 1 Fe 6 3 2 1 1 F dxz 6.632 -2 3 0 60 2917 209 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 3 0 61 2918 209 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 3 0 62 2919 209 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 3 0 63 2920 209 1 Fe 10 3 2 0 2 F dz2 2.565 -2 3 0 64 2921 209 1 Fe 11 3 2 1 2 F dxz 2.565 -2 3 0 65 2922 209 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 3 0 66 2923 209 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 3 0 67 2924 209 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 3 0 68 2925 209 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 3 0 69 2926 210 1 Fe 1 4 0 0 1 F s 9.649 -2 3 0 70 2927 210 1 Fe 2 4 0 0 2 F s 6.885 -2 3 0 71 2928 210 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 3 0 72 2929 210 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 3 0 73 2930 210 1 Fe 5 3 2 0 1 F dz2 6.632 -2 3 0 74 2931 210 1 Fe 6 3 2 1 1 F dxz 6.632 -2 3 0 75 2932 210 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 3 0 76 2933 210 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 3 0 77 2934 210 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 3 0 78 2935 210 1 Fe 10 3 2 0 2 F dz2 2.565 -2 3 0 79 2936 210 1 Fe 11 3 2 1 2 F dxz 2.565 -2 3 0 80 2937 210 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 3 0 81 2938 210 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 3 0 82 2939 210 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 3 0 83 2940 210 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 3 0 84 2941 211 3 Te 1 5 0 0 1 F s 6.195 -1 3 0 1 2942 211 3 Te 2 5 0 0 2 F s 4.205 -1 3 0 2 2943 211 3 Te 3 5 1 -1 1 F py 8.156 -1 3 0 3 2944 211 3 Te 4 5 1 0 1 F pz 8.156 -1 3 0 4 2945 211 3 Te 5 5 1 1 1 F px 8.156 -1 3 0 5 2946 211 3 Te 6 5 1 -1 2 F py 5.009 -1 3 0 6 2947 211 3 Te 7 5 1 0 2 F pz 5.009 -1 3 0 7 2948 211 3 Te 8 5 1 1 2 F px 5.009 -1 3 0 8 2949 211 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 3 0 9 2950 211 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 3 0 10 2951 211 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 3 0 11 2952 211 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 3 0 12 2953 211 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 3 0 13 2954 212 3 Te 1 5 0 0 1 F s 6.195 -1 3 0 14 2955 212 3 Te 2 5 0 0 2 F s 4.205 -1 3 0 15 2956 212 3 Te 3 5 1 -1 1 F py 8.156 -1 3 0 16 2957 212 3 Te 4 5 1 0 1 F pz 8.156 -1 3 0 17 2958 212 3 Te 5 5 1 1 1 F px 8.156 -1 3 0 18 2959 212 3 Te 6 5 1 -1 2 F py 5.009 -1 3 0 19 2960 212 3 Te 7 5 1 0 2 F pz 5.009 -1 3 0 20 2961 212 3 Te 8 5 1 1 2 F px 5.009 -1 3 0 21 2962 212 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 3 0 22 2963 212 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 3 0 23 2964 212 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 3 0 24 2965 212 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 3 0 25 2966 212 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 3 0 26 2967 213 2 Ge 1 4 0 0 1 F s 6.581 -1 3 0 27 2968 213 2 Ge 2 4 0 0 2 F s 4.412 -1 3 0 28 2969 213 2 Ge 3 4 1 -1 1 F py 9.340 -1 3 0 29 2970 213 2 Ge 4 4 1 0 1 F pz 9.340 -1 3 0 30 2971 213 2 Ge 5 4 1 1 1 F px 9.340 -1 3 0 31 2972 213 2 Ge 6 4 1 -1 2 F py 5.665 -1 3 0 32 2973 213 2 Ge 7 4 1 0 2 F pz 5.665 -1 3 0 33 2974 213 2 Ge 8 4 1 1 2 F px 5.665 -1 3 0 34 2975 213 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 3 0 35 2976 213 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 3 0 36 2977 213 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 3 0 37 2978 213 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 3 0 38 2979 213 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 3 0 39 2980 214 1 Fe 1 4 0 0 1 F s 9.649 -1 3 0 40 2981 214 1 Fe 2 4 0 0 2 F s 6.885 -1 3 0 41 2982 214 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 3 0 42 2983 214 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 3 0 43 2984 214 1 Fe 5 3 2 0 1 F dz2 6.632 -1 3 0 44 2985 214 1 Fe 6 3 2 1 1 F dxz 6.632 -1 3 0 45 2986 214 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 3 0 46 2987 214 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 3 0 47 2988 214 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 3 0 48 2989 214 1 Fe 10 3 2 0 2 F dz2 2.565 -1 3 0 49 2990 214 1 Fe 11 3 2 1 2 F dxz 2.565 -1 3 0 50 2991 214 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 3 0 51 2992 214 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 3 0 52 2993 214 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 3 0 53 2994 214 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 3 0 54 2995 215 1 Fe 1 4 0 0 1 F s 9.649 -1 3 0 55 2996 215 1 Fe 2 4 0 0 2 F s 6.885 -1 3 0 56 2997 215 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 3 0 57 2998 215 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 3 0 58 2999 215 1 Fe 5 3 2 0 1 F dz2 6.632 -1 3 0 59 3000 215 1 Fe 6 3 2 1 1 F dxz 6.632 -1 3 0 60 3001 215 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 3 0 61 3002 215 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 3 0 62 3003 215 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 3 0 63 3004 215 1 Fe 10 3 2 0 2 F dz2 2.565 -1 3 0 64 3005 215 1 Fe 11 3 2 1 2 F dxz 2.565 -1 3 0 65 3006 215 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 3 0 66 3007 215 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 3 0 67 3008 215 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 3 0 68 3009 215 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 3 0 69 3010 216 1 Fe 1 4 0 0 1 F s 9.649 -1 3 0 70 3011 216 1 Fe 2 4 0 0 2 F s 6.885 -1 3 0 71 3012 216 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 3 0 72 3013 216 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 3 0 73 3014 216 1 Fe 5 3 2 0 1 F dz2 6.632 -1 3 0 74 3015 216 1 Fe 6 3 2 1 1 F dxz 6.632 -1 3 0 75 3016 216 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 3 0 76 3017 216 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 3 0 77 3018 216 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 3 0 78 3019 216 1 Fe 10 3 2 0 2 F dz2 2.565 -1 3 0 79 3020 216 1 Fe 11 3 2 1 2 F dxz 2.565 -1 3 0 80 3021 216 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 3 0 81 3022 216 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 3 0 82 3023 216 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 3 0 83 3024 216 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 3 0 84 3025 217 3 Te 1 5 0 0 1 F s 6.195 0 4 0 1 3026 217 3 Te 2 5 0 0 2 F s 4.205 0 4 0 2 3027 217 3 Te 3 5 1 -1 1 F py 8.156 0 4 0 3 3028 217 3 Te 4 5 1 0 1 F pz 8.156 0 4 0 4 3029 217 3 Te 5 5 1 1 1 F px 8.156 0 4 0 5 3030 217 3 Te 6 5 1 -1 2 F py 5.009 0 4 0 6 3031 217 3 Te 7 5 1 0 2 F pz 5.009 0 4 0 7 3032 217 3 Te 8 5 1 1 2 F px 5.009 0 4 0 8 3033 217 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 4 0 9 3034 217 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 4 0 10 3035 217 3 Te 11 5 2 0 1 T Pdz2 8.156 0 4 0 11 3036 217 3 Te 12 5 2 1 1 T Pdxz 8.156 0 4 0 12 3037 217 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 4 0 13 3038 218 3 Te 1 5 0 0 1 F s 6.195 0 4 0 14 3039 218 3 Te 2 5 0 0 2 F s 4.205 0 4 0 15 3040 218 3 Te 3 5 1 -1 1 F py 8.156 0 4 0 16 3041 218 3 Te 4 5 1 0 1 F pz 8.156 0 4 0 17 3042 218 3 Te 5 5 1 1 1 F px 8.156 0 4 0 18 3043 218 3 Te 6 5 1 -1 2 F py 5.009 0 4 0 19 3044 218 3 Te 7 5 1 0 2 F pz 5.009 0 4 0 20 3045 218 3 Te 8 5 1 1 2 F px 5.009 0 4 0 21 3046 218 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 4 0 22 3047 218 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 4 0 23 3048 218 3 Te 11 5 2 0 1 T Pdz2 8.156 0 4 0 24 3049 218 3 Te 12 5 2 1 1 T Pdxz 8.156 0 4 0 25 3050 218 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 4 0 26 3051 219 2 Ge 1 4 0 0 1 F s 6.581 0 4 0 27 3052 219 2 Ge 2 4 0 0 2 F s 4.412 0 4 0 28 3053 219 2 Ge 3 4 1 -1 1 F py 9.340 0 4 0 29 3054 219 2 Ge 4 4 1 0 1 F pz 9.340 0 4 0 30 3055 219 2 Ge 5 4 1 1 1 F px 9.340 0 4 0 31 3056 219 2 Ge 6 4 1 -1 2 F py 5.665 0 4 0 32 3057 219 2 Ge 7 4 1 0 2 F pz 5.665 0 4 0 33 3058 219 2 Ge 8 4 1 1 2 F px 5.665 0 4 0 34 3059 219 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 4 0 35 3060 219 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 4 0 36 3061 219 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 4 0 37 3062 219 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 4 0 38 3063 219 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 4 0 39 3064 220 1 Fe 1 4 0 0 1 F s 9.649 0 4 0 40 3065 220 1 Fe 2 4 0 0 2 F s 6.885 0 4 0 41 3066 220 1 Fe 3 3 2 -2 1 F dxy 6.632 0 4 0 42 3067 220 1 Fe 4 3 2 -1 1 F dyz 6.632 0 4 0 43 3068 220 1 Fe 5 3 2 0 1 F dz2 6.632 0 4 0 44 3069 220 1 Fe 6 3 2 1 1 F dxz 6.632 0 4 0 45 3070 220 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 4 0 46 3071 220 1 Fe 8 3 2 -2 2 F dxy 2.565 0 4 0 47 3072 220 1 Fe 9 3 2 -1 2 F dyz 2.565 0 4 0 48 3073 220 1 Fe 10 3 2 0 2 F dz2 2.565 0 4 0 49 3074 220 1 Fe 11 3 2 1 2 F dxz 2.565 0 4 0 50 3075 220 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 4 0 51 3076 220 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 4 0 52 3077 220 1 Fe 14 4 1 0 1 T Ppz 9.649 0 4 0 53 3078 220 1 Fe 15 4 1 1 1 T Ppx 9.649 0 4 0 54 3079 221 1 Fe 1 4 0 0 1 F s 9.649 0 4 0 55 3080 221 1 Fe 2 4 0 0 2 F s 6.885 0 4 0 56 3081 221 1 Fe 3 3 2 -2 1 F dxy 6.632 0 4 0 57 3082 221 1 Fe 4 3 2 -1 1 F dyz 6.632 0 4 0 58 3083 221 1 Fe 5 3 2 0 1 F dz2 6.632 0 4 0 59 3084 221 1 Fe 6 3 2 1 1 F dxz 6.632 0 4 0 60 3085 221 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 4 0 61 3086 221 1 Fe 8 3 2 -2 2 F dxy 2.565 0 4 0 62 3087 221 1 Fe 9 3 2 -1 2 F dyz 2.565 0 4 0 63 3088 221 1 Fe 10 3 2 0 2 F dz2 2.565 0 4 0 64 3089 221 1 Fe 11 3 2 1 2 F dxz 2.565 0 4 0 65 3090 221 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 4 0 66 3091 221 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 4 0 67 3092 221 1 Fe 14 4 1 0 1 T Ppz 9.649 0 4 0 68 3093 221 1 Fe 15 4 1 1 1 T Ppx 9.649 0 4 0 69 3094 222 1 Fe 1 4 0 0 1 F s 9.649 0 4 0 70 3095 222 1 Fe 2 4 0 0 2 F s 6.885 0 4 0 71 3096 222 1 Fe 3 3 2 -2 1 F dxy 6.632 0 4 0 72 3097 222 1 Fe 4 3 2 -1 1 F dyz 6.632 0 4 0 73 3098 222 1 Fe 5 3 2 0 1 F dz2 6.632 0 4 0 74 3099 222 1 Fe 6 3 2 1 1 F dxz 6.632 0 4 0 75 3100 222 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 4 0 76 3101 222 1 Fe 8 3 2 -2 2 F dxy 2.565 0 4 0 77 3102 222 1 Fe 9 3 2 -1 2 F dyz 2.565 0 4 0 78 3103 222 1 Fe 10 3 2 0 2 F dz2 2.565 0 4 0 79 3104 222 1 Fe 11 3 2 1 2 F dxz 2.565 0 4 0 80 3105 222 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 4 0 81 3106 222 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 4 0 82 3107 222 1 Fe 14 4 1 0 1 T Ppz 9.649 0 4 0 83 3108 222 1 Fe 15 4 1 1 1 T Ppx 9.649 0 4 0 84 3109 223 3 Te 1 5 0 0 1 F s 6.195 1 4 0 1 3110 223 3 Te 2 5 0 0 2 F s 4.205 1 4 0 2 3111 223 3 Te 3 5 1 -1 1 F py 8.156 1 4 0 3 3112 223 3 Te 4 5 1 0 1 F pz 8.156 1 4 0 4 3113 223 3 Te 5 5 1 1 1 F px 8.156 1 4 0 5 3114 223 3 Te 6 5 1 -1 2 F py 5.009 1 4 0 6 3115 223 3 Te 7 5 1 0 2 F pz 5.009 1 4 0 7 3116 223 3 Te 8 5 1 1 2 F px 5.009 1 4 0 8 3117 223 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 4 0 9 3118 223 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 4 0 10 3119 223 3 Te 11 5 2 0 1 T Pdz2 8.156 1 4 0 11 3120 223 3 Te 12 5 2 1 1 T Pdxz 8.156 1 4 0 12 3121 223 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 4 0 13 3122 224 3 Te 1 5 0 0 1 F s 6.195 1 4 0 14 3123 224 3 Te 2 5 0 0 2 F s 4.205 1 4 0 15 3124 224 3 Te 3 5 1 -1 1 F py 8.156 1 4 0 16 3125 224 3 Te 4 5 1 0 1 F pz 8.156 1 4 0 17 3126 224 3 Te 5 5 1 1 1 F px 8.156 1 4 0 18 3127 224 3 Te 6 5 1 -1 2 F py 5.009 1 4 0 19 3128 224 3 Te 7 5 1 0 2 F pz 5.009 1 4 0 20 3129 224 3 Te 8 5 1 1 2 F px 5.009 1 4 0 21 3130 224 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 4 0 22 3131 224 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 4 0 23 3132 224 3 Te 11 5 2 0 1 T Pdz2 8.156 1 4 0 24 3133 224 3 Te 12 5 2 1 1 T Pdxz 8.156 1 4 0 25 3134 224 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 4 0 26 3135 225 2 Ge 1 4 0 0 1 F s 6.581 1 4 0 27 3136 225 2 Ge 2 4 0 0 2 F s 4.412 1 4 0 28 3137 225 2 Ge 3 4 1 -1 1 F py 9.340 1 4 0 29 3138 225 2 Ge 4 4 1 0 1 F pz 9.340 1 4 0 30 3139 225 2 Ge 5 4 1 1 1 F px 9.340 1 4 0 31 3140 225 2 Ge 6 4 1 -1 2 F py 5.665 1 4 0 32 3141 225 2 Ge 7 4 1 0 2 F pz 5.665 1 4 0 33 3142 225 2 Ge 8 4 1 1 2 F px 5.665 1 4 0 34 3143 225 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 4 0 35 3144 225 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 4 0 36 3145 225 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 4 0 37 3146 225 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 4 0 38 3147 225 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 4 0 39 3148 226 1 Fe 1 4 0 0 1 F s 9.649 1 4 0 40 3149 226 1 Fe 2 4 0 0 2 F s 6.885 1 4 0 41 3150 226 1 Fe 3 3 2 -2 1 F dxy 6.632 1 4 0 42 3151 226 1 Fe 4 3 2 -1 1 F dyz 6.632 1 4 0 43 3152 226 1 Fe 5 3 2 0 1 F dz2 6.632 1 4 0 44 3153 226 1 Fe 6 3 2 1 1 F dxz 6.632 1 4 0 45 3154 226 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 4 0 46 3155 226 1 Fe 8 3 2 -2 2 F dxy 2.565 1 4 0 47 3156 226 1 Fe 9 3 2 -1 2 F dyz 2.565 1 4 0 48 3157 226 1 Fe 10 3 2 0 2 F dz2 2.565 1 4 0 49 3158 226 1 Fe 11 3 2 1 2 F dxz 2.565 1 4 0 50 3159 226 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 4 0 51 3160 226 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 4 0 52 3161 226 1 Fe 14 4 1 0 1 T Ppz 9.649 1 4 0 53 3162 226 1 Fe 15 4 1 1 1 T Ppx 9.649 1 4 0 54 3163 227 1 Fe 1 4 0 0 1 F s 9.649 1 4 0 55 3164 227 1 Fe 2 4 0 0 2 F s 6.885 1 4 0 56 3165 227 1 Fe 3 3 2 -2 1 F dxy 6.632 1 4 0 57 3166 227 1 Fe 4 3 2 -1 1 F dyz 6.632 1 4 0 58 3167 227 1 Fe 5 3 2 0 1 F dz2 6.632 1 4 0 59 3168 227 1 Fe 6 3 2 1 1 F dxz 6.632 1 4 0 60 3169 227 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 4 0 61 3170 227 1 Fe 8 3 2 -2 2 F dxy 2.565 1 4 0 62 3171 227 1 Fe 9 3 2 -1 2 F dyz 2.565 1 4 0 63 3172 227 1 Fe 10 3 2 0 2 F dz2 2.565 1 4 0 64 3173 227 1 Fe 11 3 2 1 2 F dxz 2.565 1 4 0 65 3174 227 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 4 0 66 3175 227 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 4 0 67 3176 227 1 Fe 14 4 1 0 1 T Ppz 9.649 1 4 0 68 3177 227 1 Fe 15 4 1 1 1 T Ppx 9.649 1 4 0 69 3178 228 1 Fe 1 4 0 0 1 F s 9.649 1 4 0 70 3179 228 1 Fe 2 4 0 0 2 F s 6.885 1 4 0 71 3180 228 1 Fe 3 3 2 -2 1 F dxy 6.632 1 4 0 72 3181 228 1 Fe 4 3 2 -1 1 F dyz 6.632 1 4 0 73 3182 228 1 Fe 5 3 2 0 1 F dz2 6.632 1 4 0 74 3183 228 1 Fe 6 3 2 1 1 F dxz 6.632 1 4 0 75 3184 228 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 4 0 76 3185 228 1 Fe 8 3 2 -2 2 F dxy 2.565 1 4 0 77 3186 228 1 Fe 9 3 2 -1 2 F dyz 2.565 1 4 0 78 3187 228 1 Fe 10 3 2 0 2 F dz2 2.565 1 4 0 79 3188 228 1 Fe 11 3 2 1 2 F dxz 2.565 1 4 0 80 3189 228 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 4 0 81 3190 228 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 4 0 82 3191 228 1 Fe 14 4 1 0 1 T Ppz 9.649 1 4 0 83 3192 228 1 Fe 15 4 1 1 1 T Ppx 9.649 1 4 0 84 3193 229 3 Te 1 5 0 0 1 F s 6.195 2 4 0 1 3194 229 3 Te 2 5 0 0 2 F s 4.205 2 4 0 2 3195 229 3 Te 3 5 1 -1 1 F py 8.156 2 4 0 3 3196 229 3 Te 4 5 1 0 1 F pz 8.156 2 4 0 4 3197 229 3 Te 5 5 1 1 1 F px 8.156 2 4 0 5 3198 229 3 Te 6 5 1 -1 2 F py 5.009 2 4 0 6 3199 229 3 Te 7 5 1 0 2 F pz 5.009 2 4 0 7 3200 229 3 Te 8 5 1 1 2 F px 5.009 2 4 0 8 3201 229 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 4 0 9 3202 229 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 4 0 10 3203 229 3 Te 11 5 2 0 1 T Pdz2 8.156 2 4 0 11 3204 229 3 Te 12 5 2 1 1 T Pdxz 8.156 2 4 0 12 3205 229 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 4 0 13 3206 230 3 Te 1 5 0 0 1 F s 6.195 2 4 0 14 3207 230 3 Te 2 5 0 0 2 F s 4.205 2 4 0 15 3208 230 3 Te 3 5 1 -1 1 F py 8.156 2 4 0 16 3209 230 3 Te 4 5 1 0 1 F pz 8.156 2 4 0 17 3210 230 3 Te 5 5 1 1 1 F px 8.156 2 4 0 18 3211 230 3 Te 6 5 1 -1 2 F py 5.009 2 4 0 19 3212 230 3 Te 7 5 1 0 2 F pz 5.009 2 4 0 20 3213 230 3 Te 8 5 1 1 2 F px 5.009 2 4 0 21 3214 230 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 4 0 22 3215 230 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 4 0 23 3216 230 3 Te 11 5 2 0 1 T Pdz2 8.156 2 4 0 24 3217 230 3 Te 12 5 2 1 1 T Pdxz 8.156 2 4 0 25 3218 230 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 4 0 26 3219 231 2 Ge 1 4 0 0 1 F s 6.581 2 4 0 27 3220 231 2 Ge 2 4 0 0 2 F s 4.412 2 4 0 28 3221 231 2 Ge 3 4 1 -1 1 F py 9.340 2 4 0 29 3222 231 2 Ge 4 4 1 0 1 F pz 9.340 2 4 0 30 3223 231 2 Ge 5 4 1 1 1 F px 9.340 2 4 0 31 3224 231 2 Ge 6 4 1 -1 2 F py 5.665 2 4 0 32 3225 231 2 Ge 7 4 1 0 2 F pz 5.665 2 4 0 33 3226 231 2 Ge 8 4 1 1 2 F px 5.665 2 4 0 34 3227 231 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 4 0 35 3228 231 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 4 0 36 3229 231 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 4 0 37 3230 231 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 4 0 38 3231 231 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 4 0 39 3232 232 1 Fe 1 4 0 0 1 F s 9.649 2 4 0 40 3233 232 1 Fe 2 4 0 0 2 F s 6.885 2 4 0 41 3234 232 1 Fe 3 3 2 -2 1 F dxy 6.632 2 4 0 42 3235 232 1 Fe 4 3 2 -1 1 F dyz 6.632 2 4 0 43 3236 232 1 Fe 5 3 2 0 1 F dz2 6.632 2 4 0 44 3237 232 1 Fe 6 3 2 1 1 F dxz 6.632 2 4 0 45 3238 232 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 4 0 46 3239 232 1 Fe 8 3 2 -2 2 F dxy 2.565 2 4 0 47 3240 232 1 Fe 9 3 2 -1 2 F dyz 2.565 2 4 0 48 3241 232 1 Fe 10 3 2 0 2 F dz2 2.565 2 4 0 49 3242 232 1 Fe 11 3 2 1 2 F dxz 2.565 2 4 0 50 3243 232 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 4 0 51 3244 232 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 4 0 52 3245 232 1 Fe 14 4 1 0 1 T Ppz 9.649 2 4 0 53 3246 232 1 Fe 15 4 1 1 1 T Ppx 9.649 2 4 0 54 3247 233 1 Fe 1 4 0 0 1 F s 9.649 2 4 0 55 3248 233 1 Fe 2 4 0 0 2 F s 6.885 2 4 0 56 3249 233 1 Fe 3 3 2 -2 1 F dxy 6.632 2 4 0 57 3250 233 1 Fe 4 3 2 -1 1 F dyz 6.632 2 4 0 58 3251 233 1 Fe 5 3 2 0 1 F dz2 6.632 2 4 0 59 3252 233 1 Fe 6 3 2 1 1 F dxz 6.632 2 4 0 60 3253 233 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 4 0 61 3254 233 1 Fe 8 3 2 -2 2 F dxy 2.565 2 4 0 62 3255 233 1 Fe 9 3 2 -1 2 F dyz 2.565 2 4 0 63 3256 233 1 Fe 10 3 2 0 2 F dz2 2.565 2 4 0 64 3257 233 1 Fe 11 3 2 1 2 F dxz 2.565 2 4 0 65 3258 233 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 4 0 66 3259 233 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 4 0 67 3260 233 1 Fe 14 4 1 0 1 T Ppz 9.649 2 4 0 68 3261 233 1 Fe 15 4 1 1 1 T Ppx 9.649 2 4 0 69 3262 234 1 Fe 1 4 0 0 1 F s 9.649 2 4 0 70 3263 234 1 Fe 2 4 0 0 2 F s 6.885 2 4 0 71 3264 234 1 Fe 3 3 2 -2 1 F dxy 6.632 2 4 0 72 3265 234 1 Fe 4 3 2 -1 1 F dyz 6.632 2 4 0 73 3266 234 1 Fe 5 3 2 0 1 F dz2 6.632 2 4 0 74 3267 234 1 Fe 6 3 2 1 1 F dxz 6.632 2 4 0 75 3268 234 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 4 0 76 3269 234 1 Fe 8 3 2 -2 2 F dxy 2.565 2 4 0 77 3270 234 1 Fe 9 3 2 -1 2 F dyz 2.565 2 4 0 78 3271 234 1 Fe 10 3 2 0 2 F dz2 2.565 2 4 0 79 3272 234 1 Fe 11 3 2 1 2 F dxz 2.565 2 4 0 80 3273 234 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 4 0 81 3274 234 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 4 0 82 3275 234 1 Fe 14 4 1 0 1 T Ppz 9.649 2 4 0 83 3276 234 1 Fe 15 4 1 1 1 T Ppx 9.649 2 4 0 84 3277 235 3 Te 1 5 0 0 1 F s 6.195 3 4 0 1 3278 235 3 Te 2 5 0 0 2 F s 4.205 3 4 0 2 3279 235 3 Te 3 5 1 -1 1 F py 8.156 3 4 0 3 3280 235 3 Te 4 5 1 0 1 F pz 8.156 3 4 0 4 3281 235 3 Te 5 5 1 1 1 F px 8.156 3 4 0 5 3282 235 3 Te 6 5 1 -1 2 F py 5.009 3 4 0 6 3283 235 3 Te 7 5 1 0 2 F pz 5.009 3 4 0 7 3284 235 3 Te 8 5 1 1 2 F px 5.009 3 4 0 8 3285 235 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 4 0 9 3286 235 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 4 0 10 3287 235 3 Te 11 5 2 0 1 T Pdz2 8.156 3 4 0 11 3288 235 3 Te 12 5 2 1 1 T Pdxz 8.156 3 4 0 12 3289 235 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 4 0 13 3290 236 3 Te 1 5 0 0 1 F s 6.195 3 4 0 14 3291 236 3 Te 2 5 0 0 2 F s 4.205 3 4 0 15 3292 236 3 Te 3 5 1 -1 1 F py 8.156 3 4 0 16 3293 236 3 Te 4 5 1 0 1 F pz 8.156 3 4 0 17 3294 236 3 Te 5 5 1 1 1 F px 8.156 3 4 0 18 3295 236 3 Te 6 5 1 -1 2 F py 5.009 3 4 0 19 3296 236 3 Te 7 5 1 0 2 F pz 5.009 3 4 0 20 3297 236 3 Te 8 5 1 1 2 F px 5.009 3 4 0 21 3298 236 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 4 0 22 3299 236 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 4 0 23 3300 236 3 Te 11 5 2 0 1 T Pdz2 8.156 3 4 0 24 3301 236 3 Te 12 5 2 1 1 T Pdxz 8.156 3 4 0 25 3302 236 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 4 0 26 3303 237 2 Ge 1 4 0 0 1 F s 6.581 3 4 0 27 3304 237 2 Ge 2 4 0 0 2 F s 4.412 3 4 0 28 3305 237 2 Ge 3 4 1 -1 1 F py 9.340 3 4 0 29 3306 237 2 Ge 4 4 1 0 1 F pz 9.340 3 4 0 30 3307 237 2 Ge 5 4 1 1 1 F px 9.340 3 4 0 31 3308 237 2 Ge 6 4 1 -1 2 F py 5.665 3 4 0 32 3309 237 2 Ge 7 4 1 0 2 F pz 5.665 3 4 0 33 3310 237 2 Ge 8 4 1 1 2 F px 5.665 3 4 0 34 3311 237 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 4 0 35 3312 237 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 4 0 36 3313 237 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 4 0 37 3314 237 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 4 0 38 3315 237 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 4 0 39 3316 238 1 Fe 1 4 0 0 1 F s 9.649 3 4 0 40 3317 238 1 Fe 2 4 0 0 2 F s 6.885 3 4 0 41 3318 238 1 Fe 3 3 2 -2 1 F dxy 6.632 3 4 0 42 3319 238 1 Fe 4 3 2 -1 1 F dyz 6.632 3 4 0 43 3320 238 1 Fe 5 3 2 0 1 F dz2 6.632 3 4 0 44 3321 238 1 Fe 6 3 2 1 1 F dxz 6.632 3 4 0 45 3322 238 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 4 0 46 3323 238 1 Fe 8 3 2 -2 2 F dxy 2.565 3 4 0 47 3324 238 1 Fe 9 3 2 -1 2 F dyz 2.565 3 4 0 48 3325 238 1 Fe 10 3 2 0 2 F dz2 2.565 3 4 0 49 3326 238 1 Fe 11 3 2 1 2 F dxz 2.565 3 4 0 50 3327 238 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 4 0 51 3328 238 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 4 0 52 3329 238 1 Fe 14 4 1 0 1 T Ppz 9.649 3 4 0 53 3330 238 1 Fe 15 4 1 1 1 T Ppx 9.649 3 4 0 54 3331 239 1 Fe 1 4 0 0 1 F s 9.649 3 4 0 55 3332 239 1 Fe 2 4 0 0 2 F s 6.885 3 4 0 56 3333 239 1 Fe 3 3 2 -2 1 F dxy 6.632 3 4 0 57 3334 239 1 Fe 4 3 2 -1 1 F dyz 6.632 3 4 0 58 3335 239 1 Fe 5 3 2 0 1 F dz2 6.632 3 4 0 59 3336 239 1 Fe 6 3 2 1 1 F dxz 6.632 3 4 0 60 3337 239 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 4 0 61 3338 239 1 Fe 8 3 2 -2 2 F dxy 2.565 3 4 0 62 3339 239 1 Fe 9 3 2 -1 2 F dyz 2.565 3 4 0 63 3340 239 1 Fe 10 3 2 0 2 F dz2 2.565 3 4 0 64 3341 239 1 Fe 11 3 2 1 2 F dxz 2.565 3 4 0 65 3342 239 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 4 0 66 3343 239 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 4 0 67 3344 239 1 Fe 14 4 1 0 1 T Ppz 9.649 3 4 0 68 3345 239 1 Fe 15 4 1 1 1 T Ppx 9.649 3 4 0 69 3346 240 1 Fe 1 4 0 0 1 F s 9.649 3 4 0 70 3347 240 1 Fe 2 4 0 0 2 F s 6.885 3 4 0 71 3348 240 1 Fe 3 3 2 -2 1 F dxy 6.632 3 4 0 72 3349 240 1 Fe 4 3 2 -1 1 F dyz 6.632 3 4 0 73 3350 240 1 Fe 5 3 2 0 1 F dz2 6.632 3 4 0 74 3351 240 1 Fe 6 3 2 1 1 F dxz 6.632 3 4 0 75 3352 240 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 4 0 76 3353 240 1 Fe 8 3 2 -2 2 F dxy 2.565 3 4 0 77 3354 240 1 Fe 9 3 2 -1 2 F dyz 2.565 3 4 0 78 3355 240 1 Fe 10 3 2 0 2 F dz2 2.565 3 4 0 79 3356 240 1 Fe 11 3 2 1 2 F dxz 2.565 3 4 0 80 3357 240 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 4 0 81 3358 240 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 4 0 82 3359 240 1 Fe 14 4 1 0 1 T Ppz 9.649 3 4 0 83 3360 240 1 Fe 15 4 1 1 1 T Ppx 9.649 3 4 0 84 3361 241 3 Te 1 5 0 0 1 F s 6.195 4 4 0 1 3362 241 3 Te 2 5 0 0 2 F s 4.205 4 4 0 2 3363 241 3 Te 3 5 1 -1 1 F py 8.156 4 4 0 3 3364 241 3 Te 4 5 1 0 1 F pz 8.156 4 4 0 4 3365 241 3 Te 5 5 1 1 1 F px 8.156 4 4 0 5 3366 241 3 Te 6 5 1 -1 2 F py 5.009 4 4 0 6 3367 241 3 Te 7 5 1 0 2 F pz 5.009 4 4 0 7 3368 241 3 Te 8 5 1 1 2 F px 5.009 4 4 0 8 3369 241 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 4 0 9 3370 241 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 4 0 10 3371 241 3 Te 11 5 2 0 1 T Pdz2 8.156 4 4 0 11 3372 241 3 Te 12 5 2 1 1 T Pdxz 8.156 4 4 0 12 3373 241 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 4 0 13 3374 242 3 Te 1 5 0 0 1 F s 6.195 4 4 0 14 3375 242 3 Te 2 5 0 0 2 F s 4.205 4 4 0 15 3376 242 3 Te 3 5 1 -1 1 F py 8.156 4 4 0 16 3377 242 3 Te 4 5 1 0 1 F pz 8.156 4 4 0 17 3378 242 3 Te 5 5 1 1 1 F px 8.156 4 4 0 18 3379 242 3 Te 6 5 1 -1 2 F py 5.009 4 4 0 19 3380 242 3 Te 7 5 1 0 2 F pz 5.009 4 4 0 20 3381 242 3 Te 8 5 1 1 2 F px 5.009 4 4 0 21 3382 242 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 4 0 22 3383 242 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 4 0 23 3384 242 3 Te 11 5 2 0 1 T Pdz2 8.156 4 4 0 24 3385 242 3 Te 12 5 2 1 1 T Pdxz 8.156 4 4 0 25 3386 242 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 4 0 26 3387 243 2 Ge 1 4 0 0 1 F s 6.581 4 4 0 27 3388 243 2 Ge 2 4 0 0 2 F s 4.412 4 4 0 28 3389 243 2 Ge 3 4 1 -1 1 F py 9.340 4 4 0 29 3390 243 2 Ge 4 4 1 0 1 F pz 9.340 4 4 0 30 3391 243 2 Ge 5 4 1 1 1 F px 9.340 4 4 0 31 3392 243 2 Ge 6 4 1 -1 2 F py 5.665 4 4 0 32 3393 243 2 Ge 7 4 1 0 2 F pz 5.665 4 4 0 33 3394 243 2 Ge 8 4 1 1 2 F px 5.665 4 4 0 34 3395 243 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 4 0 35 3396 243 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 4 0 36 3397 243 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 4 0 37 3398 243 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 4 0 38 3399 243 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 4 0 39 3400 244 1 Fe 1 4 0 0 1 F s 9.649 4 4 0 40 3401 244 1 Fe 2 4 0 0 2 F s 6.885 4 4 0 41 3402 244 1 Fe 3 3 2 -2 1 F dxy 6.632 4 4 0 42 3403 244 1 Fe 4 3 2 -1 1 F dyz 6.632 4 4 0 43 3404 244 1 Fe 5 3 2 0 1 F dz2 6.632 4 4 0 44 3405 244 1 Fe 6 3 2 1 1 F dxz 6.632 4 4 0 45 3406 244 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 4 0 46 3407 244 1 Fe 8 3 2 -2 2 F dxy 2.565 4 4 0 47 3408 244 1 Fe 9 3 2 -1 2 F dyz 2.565 4 4 0 48 3409 244 1 Fe 10 3 2 0 2 F dz2 2.565 4 4 0 49 3410 244 1 Fe 11 3 2 1 2 F dxz 2.565 4 4 0 50 3411 244 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 4 0 51 3412 244 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 4 0 52 3413 244 1 Fe 14 4 1 0 1 T Ppz 9.649 4 4 0 53 3414 244 1 Fe 15 4 1 1 1 T Ppx 9.649 4 4 0 54 3415 245 1 Fe 1 4 0 0 1 F s 9.649 4 4 0 55 3416 245 1 Fe 2 4 0 0 2 F s 6.885 4 4 0 56 3417 245 1 Fe 3 3 2 -2 1 F dxy 6.632 4 4 0 57 3418 245 1 Fe 4 3 2 -1 1 F dyz 6.632 4 4 0 58 3419 245 1 Fe 5 3 2 0 1 F dz2 6.632 4 4 0 59 3420 245 1 Fe 6 3 2 1 1 F dxz 6.632 4 4 0 60 3421 245 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 4 0 61 3422 245 1 Fe 8 3 2 -2 2 F dxy 2.565 4 4 0 62 3423 245 1 Fe 9 3 2 -1 2 F dyz 2.565 4 4 0 63 3424 245 1 Fe 10 3 2 0 2 F dz2 2.565 4 4 0 64 3425 245 1 Fe 11 3 2 1 2 F dxz 2.565 4 4 0 65 3426 245 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 4 0 66 3427 245 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 4 0 67 3428 245 1 Fe 14 4 1 0 1 T Ppz 9.649 4 4 0 68 3429 245 1 Fe 15 4 1 1 1 T Ppx 9.649 4 4 0 69 3430 246 1 Fe 1 4 0 0 1 F s 9.649 4 4 0 70 3431 246 1 Fe 2 4 0 0 2 F s 6.885 4 4 0 71 3432 246 1 Fe 3 3 2 -2 1 F dxy 6.632 4 4 0 72 3433 246 1 Fe 4 3 2 -1 1 F dyz 6.632 4 4 0 73 3434 246 1 Fe 5 3 2 0 1 F dz2 6.632 4 4 0 74 3435 246 1 Fe 6 3 2 1 1 F dxz 6.632 4 4 0 75 3436 246 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 4 0 76 3437 246 1 Fe 8 3 2 -2 2 F dxy 2.565 4 4 0 77 3438 246 1 Fe 9 3 2 -1 2 F dyz 2.565 4 4 0 78 3439 246 1 Fe 10 3 2 0 2 F dz2 2.565 4 4 0 79 3440 246 1 Fe 11 3 2 1 2 F dxz 2.565 4 4 0 80 3441 246 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 4 0 81 3442 246 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 4 0 82 3443 246 1 Fe 14 4 1 0 1 T Ppz 9.649 4 4 0 83 3444 246 1 Fe 15 4 1 1 1 T Ppx 9.649 4 4 0 84 3445 247 3 Te 1 5 0 0 1 F s 6.195 -4 4 0 1 3446 247 3 Te 2 5 0 0 2 F s 4.205 -4 4 0 2 3447 247 3 Te 3 5 1 -1 1 F py 8.156 -4 4 0 3 3448 247 3 Te 4 5 1 0 1 F pz 8.156 -4 4 0 4 3449 247 3 Te 5 5 1 1 1 F px 8.156 -4 4 0 5 3450 247 3 Te 6 5 1 -1 2 F py 5.009 -4 4 0 6 3451 247 3 Te 7 5 1 0 2 F pz 5.009 -4 4 0 7 3452 247 3 Te 8 5 1 1 2 F px 5.009 -4 4 0 8 3453 247 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 4 0 9 3454 247 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 4 0 10 3455 247 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 4 0 11 3456 247 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 4 0 12 3457 247 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 4 0 13 3458 248 3 Te 1 5 0 0 1 F s 6.195 -4 4 0 14 3459 248 3 Te 2 5 0 0 2 F s 4.205 -4 4 0 15 3460 248 3 Te 3 5 1 -1 1 F py 8.156 -4 4 0 16 3461 248 3 Te 4 5 1 0 1 F pz 8.156 -4 4 0 17 3462 248 3 Te 5 5 1 1 1 F px 8.156 -4 4 0 18 3463 248 3 Te 6 5 1 -1 2 F py 5.009 -4 4 0 19 3464 248 3 Te 7 5 1 0 2 F pz 5.009 -4 4 0 20 3465 248 3 Te 8 5 1 1 2 F px 5.009 -4 4 0 21 3466 248 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 4 0 22 3467 248 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 4 0 23 3468 248 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 4 0 24 3469 248 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 4 0 25 3470 248 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 4 0 26 3471 249 2 Ge 1 4 0 0 1 F s 6.581 -4 4 0 27 3472 249 2 Ge 2 4 0 0 2 F s 4.412 -4 4 0 28 3473 249 2 Ge 3 4 1 -1 1 F py 9.340 -4 4 0 29 3474 249 2 Ge 4 4 1 0 1 F pz 9.340 -4 4 0 30 3475 249 2 Ge 5 4 1 1 1 F px 9.340 -4 4 0 31 3476 249 2 Ge 6 4 1 -1 2 F py 5.665 -4 4 0 32 3477 249 2 Ge 7 4 1 0 2 F pz 5.665 -4 4 0 33 3478 249 2 Ge 8 4 1 1 2 F px 5.665 -4 4 0 34 3479 249 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 4 0 35 3480 249 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 4 0 36 3481 249 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 4 0 37 3482 249 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 4 0 38 3483 249 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 4 0 39 3484 250 1 Fe 1 4 0 0 1 F s 9.649 -4 4 0 40 3485 250 1 Fe 2 4 0 0 2 F s 6.885 -4 4 0 41 3486 250 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 4 0 42 3487 250 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 4 0 43 3488 250 1 Fe 5 3 2 0 1 F dz2 6.632 -4 4 0 44 3489 250 1 Fe 6 3 2 1 1 F dxz 6.632 -4 4 0 45 3490 250 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 4 0 46 3491 250 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 4 0 47 3492 250 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 4 0 48 3493 250 1 Fe 10 3 2 0 2 F dz2 2.565 -4 4 0 49 3494 250 1 Fe 11 3 2 1 2 F dxz 2.565 -4 4 0 50 3495 250 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 4 0 51 3496 250 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 4 0 52 3497 250 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 4 0 53 3498 250 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 4 0 54 3499 251 1 Fe 1 4 0 0 1 F s 9.649 -4 4 0 55 3500 251 1 Fe 2 4 0 0 2 F s 6.885 -4 4 0 56 3501 251 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 4 0 57 3502 251 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 4 0 58 3503 251 1 Fe 5 3 2 0 1 F dz2 6.632 -4 4 0 59 3504 251 1 Fe 6 3 2 1 1 F dxz 6.632 -4 4 0 60 3505 251 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 4 0 61 3506 251 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 4 0 62 3507 251 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 4 0 63 3508 251 1 Fe 10 3 2 0 2 F dz2 2.565 -4 4 0 64 3509 251 1 Fe 11 3 2 1 2 F dxz 2.565 -4 4 0 65 3510 251 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 4 0 66 3511 251 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 4 0 67 3512 251 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 4 0 68 3513 251 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 4 0 69 3514 252 1 Fe 1 4 0 0 1 F s 9.649 -4 4 0 70 3515 252 1 Fe 2 4 0 0 2 F s 6.885 -4 4 0 71 3516 252 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 4 0 72 3517 252 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 4 0 73 3518 252 1 Fe 5 3 2 0 1 F dz2 6.632 -4 4 0 74 3519 252 1 Fe 6 3 2 1 1 F dxz 6.632 -4 4 0 75 3520 252 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 4 0 76 3521 252 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 4 0 77 3522 252 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 4 0 78 3523 252 1 Fe 10 3 2 0 2 F dz2 2.565 -4 4 0 79 3524 252 1 Fe 11 3 2 1 2 F dxz 2.565 -4 4 0 80 3525 252 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 4 0 81 3526 252 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 4 0 82 3527 252 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 4 0 83 3528 252 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 4 0 84 3529 253 3 Te 1 5 0 0 1 F s 6.195 -3 4 0 1 3530 253 3 Te 2 5 0 0 2 F s 4.205 -3 4 0 2 3531 253 3 Te 3 5 1 -1 1 F py 8.156 -3 4 0 3 3532 253 3 Te 4 5 1 0 1 F pz 8.156 -3 4 0 4 3533 253 3 Te 5 5 1 1 1 F px 8.156 -3 4 0 5 3534 253 3 Te 6 5 1 -1 2 F py 5.009 -3 4 0 6 3535 253 3 Te 7 5 1 0 2 F pz 5.009 -3 4 0 7 3536 253 3 Te 8 5 1 1 2 F px 5.009 -3 4 0 8 3537 253 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 4 0 9 3538 253 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 4 0 10 3539 253 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 4 0 11 3540 253 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 4 0 12 3541 253 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 4 0 13 3542 254 3 Te 1 5 0 0 1 F s 6.195 -3 4 0 14 3543 254 3 Te 2 5 0 0 2 F s 4.205 -3 4 0 15 3544 254 3 Te 3 5 1 -1 1 F py 8.156 -3 4 0 16 3545 254 3 Te 4 5 1 0 1 F pz 8.156 -3 4 0 17 3546 254 3 Te 5 5 1 1 1 F px 8.156 -3 4 0 18 3547 254 3 Te 6 5 1 -1 2 F py 5.009 -3 4 0 19 3548 254 3 Te 7 5 1 0 2 F pz 5.009 -3 4 0 20 3549 254 3 Te 8 5 1 1 2 F px 5.009 -3 4 0 21 3550 254 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 4 0 22 3551 254 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 4 0 23 3552 254 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 4 0 24 3553 254 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 4 0 25 3554 254 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 4 0 26 3555 255 2 Ge 1 4 0 0 1 F s 6.581 -3 4 0 27 3556 255 2 Ge 2 4 0 0 2 F s 4.412 -3 4 0 28 3557 255 2 Ge 3 4 1 -1 1 F py 9.340 -3 4 0 29 3558 255 2 Ge 4 4 1 0 1 F pz 9.340 -3 4 0 30 3559 255 2 Ge 5 4 1 1 1 F px 9.340 -3 4 0 31 3560 255 2 Ge 6 4 1 -1 2 F py 5.665 -3 4 0 32 3561 255 2 Ge 7 4 1 0 2 F pz 5.665 -3 4 0 33 3562 255 2 Ge 8 4 1 1 2 F px 5.665 -3 4 0 34 3563 255 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 4 0 35 3564 255 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 4 0 36 3565 255 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 4 0 37 3566 255 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 4 0 38 3567 255 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 4 0 39 3568 256 1 Fe 1 4 0 0 1 F s 9.649 -3 4 0 40 3569 256 1 Fe 2 4 0 0 2 F s 6.885 -3 4 0 41 3570 256 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 4 0 42 3571 256 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 4 0 43 3572 256 1 Fe 5 3 2 0 1 F dz2 6.632 -3 4 0 44 3573 256 1 Fe 6 3 2 1 1 F dxz 6.632 -3 4 0 45 3574 256 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 4 0 46 3575 256 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 4 0 47 3576 256 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 4 0 48 3577 256 1 Fe 10 3 2 0 2 F dz2 2.565 -3 4 0 49 3578 256 1 Fe 11 3 2 1 2 F dxz 2.565 -3 4 0 50 3579 256 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 4 0 51 3580 256 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 4 0 52 3581 256 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 4 0 53 3582 256 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 4 0 54 3583 257 1 Fe 1 4 0 0 1 F s 9.649 -3 4 0 55 3584 257 1 Fe 2 4 0 0 2 F s 6.885 -3 4 0 56 3585 257 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 4 0 57 3586 257 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 4 0 58 3587 257 1 Fe 5 3 2 0 1 F dz2 6.632 -3 4 0 59 3588 257 1 Fe 6 3 2 1 1 F dxz 6.632 -3 4 0 60 3589 257 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 4 0 61 3590 257 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 4 0 62 3591 257 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 4 0 63 3592 257 1 Fe 10 3 2 0 2 F dz2 2.565 -3 4 0 64 3593 257 1 Fe 11 3 2 1 2 F dxz 2.565 -3 4 0 65 3594 257 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 4 0 66 3595 257 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 4 0 67 3596 257 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 4 0 68 3597 257 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 4 0 69 3598 258 1 Fe 1 4 0 0 1 F s 9.649 -3 4 0 70 3599 258 1 Fe 2 4 0 0 2 F s 6.885 -3 4 0 71 3600 258 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 4 0 72 3601 258 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 4 0 73 3602 258 1 Fe 5 3 2 0 1 F dz2 6.632 -3 4 0 74 3603 258 1 Fe 6 3 2 1 1 F dxz 6.632 -3 4 0 75 3604 258 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 4 0 76 3605 258 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 4 0 77 3606 258 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 4 0 78 3607 258 1 Fe 10 3 2 0 2 F dz2 2.565 -3 4 0 79 3608 258 1 Fe 11 3 2 1 2 F dxz 2.565 -3 4 0 80 3609 258 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 4 0 81 3610 258 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 4 0 82 3611 258 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 4 0 83 3612 258 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 4 0 84 3613 259 3 Te 1 5 0 0 1 F s 6.195 -2 4 0 1 3614 259 3 Te 2 5 0 0 2 F s 4.205 -2 4 0 2 3615 259 3 Te 3 5 1 -1 1 F py 8.156 -2 4 0 3 3616 259 3 Te 4 5 1 0 1 F pz 8.156 -2 4 0 4 3617 259 3 Te 5 5 1 1 1 F px 8.156 -2 4 0 5 3618 259 3 Te 6 5 1 -1 2 F py 5.009 -2 4 0 6 3619 259 3 Te 7 5 1 0 2 F pz 5.009 -2 4 0 7 3620 259 3 Te 8 5 1 1 2 F px 5.009 -2 4 0 8 3621 259 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 4 0 9 3622 259 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 4 0 10 3623 259 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 4 0 11 3624 259 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 4 0 12 3625 259 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 4 0 13 3626 260 3 Te 1 5 0 0 1 F s 6.195 -2 4 0 14 3627 260 3 Te 2 5 0 0 2 F s 4.205 -2 4 0 15 3628 260 3 Te 3 5 1 -1 1 F py 8.156 -2 4 0 16 3629 260 3 Te 4 5 1 0 1 F pz 8.156 -2 4 0 17 3630 260 3 Te 5 5 1 1 1 F px 8.156 -2 4 0 18 3631 260 3 Te 6 5 1 -1 2 F py 5.009 -2 4 0 19 3632 260 3 Te 7 5 1 0 2 F pz 5.009 -2 4 0 20 3633 260 3 Te 8 5 1 1 2 F px 5.009 -2 4 0 21 3634 260 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 4 0 22 3635 260 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 4 0 23 3636 260 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 4 0 24 3637 260 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 4 0 25 3638 260 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 4 0 26 3639 261 2 Ge 1 4 0 0 1 F s 6.581 -2 4 0 27 3640 261 2 Ge 2 4 0 0 2 F s 4.412 -2 4 0 28 3641 261 2 Ge 3 4 1 -1 1 F py 9.340 -2 4 0 29 3642 261 2 Ge 4 4 1 0 1 F pz 9.340 -2 4 0 30 3643 261 2 Ge 5 4 1 1 1 F px 9.340 -2 4 0 31 3644 261 2 Ge 6 4 1 -1 2 F py 5.665 -2 4 0 32 3645 261 2 Ge 7 4 1 0 2 F pz 5.665 -2 4 0 33 3646 261 2 Ge 8 4 1 1 2 F px 5.665 -2 4 0 34 3647 261 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 4 0 35 3648 261 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 4 0 36 3649 261 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 4 0 37 3650 261 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 4 0 38 3651 261 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 4 0 39 3652 262 1 Fe 1 4 0 0 1 F s 9.649 -2 4 0 40 3653 262 1 Fe 2 4 0 0 2 F s 6.885 -2 4 0 41 3654 262 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 4 0 42 3655 262 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 4 0 43 3656 262 1 Fe 5 3 2 0 1 F dz2 6.632 -2 4 0 44 3657 262 1 Fe 6 3 2 1 1 F dxz 6.632 -2 4 0 45 3658 262 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 4 0 46 3659 262 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 4 0 47 3660 262 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 4 0 48 3661 262 1 Fe 10 3 2 0 2 F dz2 2.565 -2 4 0 49 3662 262 1 Fe 11 3 2 1 2 F dxz 2.565 -2 4 0 50 3663 262 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 4 0 51 3664 262 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 4 0 52 3665 262 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 4 0 53 3666 262 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 4 0 54 3667 263 1 Fe 1 4 0 0 1 F s 9.649 -2 4 0 55 3668 263 1 Fe 2 4 0 0 2 F s 6.885 -2 4 0 56 3669 263 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 4 0 57 3670 263 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 4 0 58 3671 263 1 Fe 5 3 2 0 1 F dz2 6.632 -2 4 0 59 3672 263 1 Fe 6 3 2 1 1 F dxz 6.632 -2 4 0 60 3673 263 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 4 0 61 3674 263 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 4 0 62 3675 263 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 4 0 63 3676 263 1 Fe 10 3 2 0 2 F dz2 2.565 -2 4 0 64 3677 263 1 Fe 11 3 2 1 2 F dxz 2.565 -2 4 0 65 3678 263 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 4 0 66 3679 263 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 4 0 67 3680 263 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 4 0 68 3681 263 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 4 0 69 3682 264 1 Fe 1 4 0 0 1 F s 9.649 -2 4 0 70 3683 264 1 Fe 2 4 0 0 2 F s 6.885 -2 4 0 71 3684 264 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 4 0 72 3685 264 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 4 0 73 3686 264 1 Fe 5 3 2 0 1 F dz2 6.632 -2 4 0 74 3687 264 1 Fe 6 3 2 1 1 F dxz 6.632 -2 4 0 75 3688 264 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 4 0 76 3689 264 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 4 0 77 3690 264 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 4 0 78 3691 264 1 Fe 10 3 2 0 2 F dz2 2.565 -2 4 0 79 3692 264 1 Fe 11 3 2 1 2 F dxz 2.565 -2 4 0 80 3693 264 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 4 0 81 3694 264 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 4 0 82 3695 264 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 4 0 83 3696 264 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 4 0 84 3697 265 3 Te 1 5 0 0 1 F s 6.195 -1 4 0 1 3698 265 3 Te 2 5 0 0 2 F s 4.205 -1 4 0 2 3699 265 3 Te 3 5 1 -1 1 F py 8.156 -1 4 0 3 3700 265 3 Te 4 5 1 0 1 F pz 8.156 -1 4 0 4 3701 265 3 Te 5 5 1 1 1 F px 8.156 -1 4 0 5 3702 265 3 Te 6 5 1 -1 2 F py 5.009 -1 4 0 6 3703 265 3 Te 7 5 1 0 2 F pz 5.009 -1 4 0 7 3704 265 3 Te 8 5 1 1 2 F px 5.009 -1 4 0 8 3705 265 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 4 0 9 3706 265 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 4 0 10 3707 265 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 4 0 11 3708 265 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 4 0 12 3709 265 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 4 0 13 3710 266 3 Te 1 5 0 0 1 F s 6.195 -1 4 0 14 3711 266 3 Te 2 5 0 0 2 F s 4.205 -1 4 0 15 3712 266 3 Te 3 5 1 -1 1 F py 8.156 -1 4 0 16 3713 266 3 Te 4 5 1 0 1 F pz 8.156 -1 4 0 17 3714 266 3 Te 5 5 1 1 1 F px 8.156 -1 4 0 18 3715 266 3 Te 6 5 1 -1 2 F py 5.009 -1 4 0 19 3716 266 3 Te 7 5 1 0 2 F pz 5.009 -1 4 0 20 3717 266 3 Te 8 5 1 1 2 F px 5.009 -1 4 0 21 3718 266 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 4 0 22 3719 266 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 4 0 23 3720 266 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 4 0 24 3721 266 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 4 0 25 3722 266 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 4 0 26 3723 267 2 Ge 1 4 0 0 1 F s 6.581 -1 4 0 27 3724 267 2 Ge 2 4 0 0 2 F s 4.412 -1 4 0 28 3725 267 2 Ge 3 4 1 -1 1 F py 9.340 -1 4 0 29 3726 267 2 Ge 4 4 1 0 1 F pz 9.340 -1 4 0 30 3727 267 2 Ge 5 4 1 1 1 F px 9.340 -1 4 0 31 3728 267 2 Ge 6 4 1 -1 2 F py 5.665 -1 4 0 32 3729 267 2 Ge 7 4 1 0 2 F pz 5.665 -1 4 0 33 3730 267 2 Ge 8 4 1 1 2 F px 5.665 -1 4 0 34 3731 267 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 4 0 35 3732 267 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 4 0 36 3733 267 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 4 0 37 3734 267 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 4 0 38 3735 267 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 4 0 39 3736 268 1 Fe 1 4 0 0 1 F s 9.649 -1 4 0 40 3737 268 1 Fe 2 4 0 0 2 F s 6.885 -1 4 0 41 3738 268 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 4 0 42 3739 268 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 4 0 43 3740 268 1 Fe 5 3 2 0 1 F dz2 6.632 -1 4 0 44 3741 268 1 Fe 6 3 2 1 1 F dxz 6.632 -1 4 0 45 3742 268 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 4 0 46 3743 268 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 4 0 47 3744 268 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 4 0 48 3745 268 1 Fe 10 3 2 0 2 F dz2 2.565 -1 4 0 49 3746 268 1 Fe 11 3 2 1 2 F dxz 2.565 -1 4 0 50 3747 268 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 4 0 51 3748 268 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 4 0 52 3749 268 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 4 0 53 3750 268 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 4 0 54 3751 269 1 Fe 1 4 0 0 1 F s 9.649 -1 4 0 55 3752 269 1 Fe 2 4 0 0 2 F s 6.885 -1 4 0 56 3753 269 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 4 0 57 3754 269 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 4 0 58 3755 269 1 Fe 5 3 2 0 1 F dz2 6.632 -1 4 0 59 3756 269 1 Fe 6 3 2 1 1 F dxz 6.632 -1 4 0 60 3757 269 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 4 0 61 3758 269 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 4 0 62 3759 269 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 4 0 63 3760 269 1 Fe 10 3 2 0 2 F dz2 2.565 -1 4 0 64 3761 269 1 Fe 11 3 2 1 2 F dxz 2.565 -1 4 0 65 3762 269 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 4 0 66 3763 269 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 4 0 67 3764 269 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 4 0 68 3765 269 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 4 0 69 3766 270 1 Fe 1 4 0 0 1 F s 9.649 -1 4 0 70 3767 270 1 Fe 2 4 0 0 2 F s 6.885 -1 4 0 71 3768 270 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 4 0 72 3769 270 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 4 0 73 3770 270 1 Fe 5 3 2 0 1 F dz2 6.632 -1 4 0 74 3771 270 1 Fe 6 3 2 1 1 F dxz 6.632 -1 4 0 75 3772 270 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 4 0 76 3773 270 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 4 0 77 3774 270 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 4 0 78 3775 270 1 Fe 10 3 2 0 2 F dz2 2.565 -1 4 0 79 3776 270 1 Fe 11 3 2 1 2 F dxz 2.565 -1 4 0 80 3777 270 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 4 0 81 3778 270 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 4 0 82 3779 270 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 4 0 83 3780 270 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 4 0 84 3781 271 3 Te 1 5 0 0 1 F s 6.195 0 -4 0 1 3782 271 3 Te 2 5 0 0 2 F s 4.205 0 -4 0 2 3783 271 3 Te 3 5 1 -1 1 F py 8.156 0 -4 0 3 3784 271 3 Te 4 5 1 0 1 F pz 8.156 0 -4 0 4 3785 271 3 Te 5 5 1 1 1 F px 8.156 0 -4 0 5 3786 271 3 Te 6 5 1 -1 2 F py 5.009 0 -4 0 6 3787 271 3 Te 7 5 1 0 2 F pz 5.009 0 -4 0 7 3788 271 3 Te 8 5 1 1 2 F px 5.009 0 -4 0 8 3789 271 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -4 0 9 3790 271 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -4 0 10 3791 271 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -4 0 11 3792 271 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -4 0 12 3793 271 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -4 0 13 3794 272 3 Te 1 5 0 0 1 F s 6.195 0 -4 0 14 3795 272 3 Te 2 5 0 0 2 F s 4.205 0 -4 0 15 3796 272 3 Te 3 5 1 -1 1 F py 8.156 0 -4 0 16 3797 272 3 Te 4 5 1 0 1 F pz 8.156 0 -4 0 17 3798 272 3 Te 5 5 1 1 1 F px 8.156 0 -4 0 18 3799 272 3 Te 6 5 1 -1 2 F py 5.009 0 -4 0 19 3800 272 3 Te 7 5 1 0 2 F pz 5.009 0 -4 0 20 3801 272 3 Te 8 5 1 1 2 F px 5.009 0 -4 0 21 3802 272 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -4 0 22 3803 272 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -4 0 23 3804 272 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -4 0 24 3805 272 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -4 0 25 3806 272 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -4 0 26 3807 273 2 Ge 1 4 0 0 1 F s 6.581 0 -4 0 27 3808 273 2 Ge 2 4 0 0 2 F s 4.412 0 -4 0 28 3809 273 2 Ge 3 4 1 -1 1 F py 9.340 0 -4 0 29 3810 273 2 Ge 4 4 1 0 1 F pz 9.340 0 -4 0 30 3811 273 2 Ge 5 4 1 1 1 F px 9.340 0 -4 0 31 3812 273 2 Ge 6 4 1 -1 2 F py 5.665 0 -4 0 32 3813 273 2 Ge 7 4 1 0 2 F pz 5.665 0 -4 0 33 3814 273 2 Ge 8 4 1 1 2 F px 5.665 0 -4 0 34 3815 273 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 -4 0 35 3816 273 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 -4 0 36 3817 273 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 -4 0 37 3818 273 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 -4 0 38 3819 273 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 -4 0 39 3820 274 1 Fe 1 4 0 0 1 F s 9.649 0 -4 0 40 3821 274 1 Fe 2 4 0 0 2 F s 6.885 0 -4 0 41 3822 274 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -4 0 42 3823 274 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -4 0 43 3824 274 1 Fe 5 3 2 0 1 F dz2 6.632 0 -4 0 44 3825 274 1 Fe 6 3 2 1 1 F dxz 6.632 0 -4 0 45 3826 274 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -4 0 46 3827 274 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -4 0 47 3828 274 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -4 0 48 3829 274 1 Fe 10 3 2 0 2 F dz2 2.565 0 -4 0 49 3830 274 1 Fe 11 3 2 1 2 F dxz 2.565 0 -4 0 50 3831 274 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -4 0 51 3832 274 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -4 0 52 3833 274 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -4 0 53 3834 274 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -4 0 54 3835 275 1 Fe 1 4 0 0 1 F s 9.649 0 -4 0 55 3836 275 1 Fe 2 4 0 0 2 F s 6.885 0 -4 0 56 3837 275 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -4 0 57 3838 275 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -4 0 58 3839 275 1 Fe 5 3 2 0 1 F dz2 6.632 0 -4 0 59 3840 275 1 Fe 6 3 2 1 1 F dxz 6.632 0 -4 0 60 3841 275 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -4 0 61 3842 275 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -4 0 62 3843 275 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -4 0 63 3844 275 1 Fe 10 3 2 0 2 F dz2 2.565 0 -4 0 64 3845 275 1 Fe 11 3 2 1 2 F dxz 2.565 0 -4 0 65 3846 275 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -4 0 66 3847 275 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -4 0 67 3848 275 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -4 0 68 3849 275 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -4 0 69 3850 276 1 Fe 1 4 0 0 1 F s 9.649 0 -4 0 70 3851 276 1 Fe 2 4 0 0 2 F s 6.885 0 -4 0 71 3852 276 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -4 0 72 3853 276 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -4 0 73 3854 276 1 Fe 5 3 2 0 1 F dz2 6.632 0 -4 0 74 3855 276 1 Fe 6 3 2 1 1 F dxz 6.632 0 -4 0 75 3856 276 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -4 0 76 3857 276 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -4 0 77 3858 276 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -4 0 78 3859 276 1 Fe 10 3 2 0 2 F dz2 2.565 0 -4 0 79 3860 276 1 Fe 11 3 2 1 2 F dxz 2.565 0 -4 0 80 3861 276 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -4 0 81 3862 276 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -4 0 82 3863 276 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -4 0 83 3864 276 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -4 0 84 3865 277 3 Te 1 5 0 0 1 F s 6.195 1 -4 0 1 3866 277 3 Te 2 5 0 0 2 F s 4.205 1 -4 0 2 3867 277 3 Te 3 5 1 -1 1 F py 8.156 1 -4 0 3 3868 277 3 Te 4 5 1 0 1 F pz 8.156 1 -4 0 4 3869 277 3 Te 5 5 1 1 1 F px 8.156 1 -4 0 5 3870 277 3 Te 6 5 1 -1 2 F py 5.009 1 -4 0 6 3871 277 3 Te 7 5 1 0 2 F pz 5.009 1 -4 0 7 3872 277 3 Te 8 5 1 1 2 F px 5.009 1 -4 0 8 3873 277 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -4 0 9 3874 277 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -4 0 10 3875 277 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -4 0 11 3876 277 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -4 0 12 3877 277 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -4 0 13 3878 278 3 Te 1 5 0 0 1 F s 6.195 1 -4 0 14 3879 278 3 Te 2 5 0 0 2 F s 4.205 1 -4 0 15 3880 278 3 Te 3 5 1 -1 1 F py 8.156 1 -4 0 16 3881 278 3 Te 4 5 1 0 1 F pz 8.156 1 -4 0 17 3882 278 3 Te 5 5 1 1 1 F px 8.156 1 -4 0 18 3883 278 3 Te 6 5 1 -1 2 F py 5.009 1 -4 0 19 3884 278 3 Te 7 5 1 0 2 F pz 5.009 1 -4 0 20 3885 278 3 Te 8 5 1 1 2 F px 5.009 1 -4 0 21 3886 278 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -4 0 22 3887 278 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -4 0 23 3888 278 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -4 0 24 3889 278 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -4 0 25 3890 278 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -4 0 26 3891 279 2 Ge 1 4 0 0 1 F s 6.581 1 -4 0 27 3892 279 2 Ge 2 4 0 0 2 F s 4.412 1 -4 0 28 3893 279 2 Ge 3 4 1 -1 1 F py 9.340 1 -4 0 29 3894 279 2 Ge 4 4 1 0 1 F pz 9.340 1 -4 0 30 3895 279 2 Ge 5 4 1 1 1 F px 9.340 1 -4 0 31 3896 279 2 Ge 6 4 1 -1 2 F py 5.665 1 -4 0 32 3897 279 2 Ge 7 4 1 0 2 F pz 5.665 1 -4 0 33 3898 279 2 Ge 8 4 1 1 2 F px 5.665 1 -4 0 34 3899 279 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 -4 0 35 3900 279 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 -4 0 36 3901 279 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 -4 0 37 3902 279 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 -4 0 38 3903 279 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 -4 0 39 3904 280 1 Fe 1 4 0 0 1 F s 9.649 1 -4 0 40 3905 280 1 Fe 2 4 0 0 2 F s 6.885 1 -4 0 41 3906 280 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -4 0 42 3907 280 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -4 0 43 3908 280 1 Fe 5 3 2 0 1 F dz2 6.632 1 -4 0 44 3909 280 1 Fe 6 3 2 1 1 F dxz 6.632 1 -4 0 45 3910 280 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -4 0 46 3911 280 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -4 0 47 3912 280 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -4 0 48 3913 280 1 Fe 10 3 2 0 2 F dz2 2.565 1 -4 0 49 3914 280 1 Fe 11 3 2 1 2 F dxz 2.565 1 -4 0 50 3915 280 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -4 0 51 3916 280 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -4 0 52 3917 280 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -4 0 53 3918 280 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -4 0 54 3919 281 1 Fe 1 4 0 0 1 F s 9.649 1 -4 0 55 3920 281 1 Fe 2 4 0 0 2 F s 6.885 1 -4 0 56 3921 281 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -4 0 57 3922 281 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -4 0 58 3923 281 1 Fe 5 3 2 0 1 F dz2 6.632 1 -4 0 59 3924 281 1 Fe 6 3 2 1 1 F dxz 6.632 1 -4 0 60 3925 281 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -4 0 61 3926 281 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -4 0 62 3927 281 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -4 0 63 3928 281 1 Fe 10 3 2 0 2 F dz2 2.565 1 -4 0 64 3929 281 1 Fe 11 3 2 1 2 F dxz 2.565 1 -4 0 65 3930 281 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -4 0 66 3931 281 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -4 0 67 3932 281 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -4 0 68 3933 281 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -4 0 69 3934 282 1 Fe 1 4 0 0 1 F s 9.649 1 -4 0 70 3935 282 1 Fe 2 4 0 0 2 F s 6.885 1 -4 0 71 3936 282 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -4 0 72 3937 282 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -4 0 73 3938 282 1 Fe 5 3 2 0 1 F dz2 6.632 1 -4 0 74 3939 282 1 Fe 6 3 2 1 1 F dxz 6.632 1 -4 0 75 3940 282 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -4 0 76 3941 282 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -4 0 77 3942 282 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -4 0 78 3943 282 1 Fe 10 3 2 0 2 F dz2 2.565 1 -4 0 79 3944 282 1 Fe 11 3 2 1 2 F dxz 2.565 1 -4 0 80 3945 282 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -4 0 81 3946 282 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -4 0 82 3947 282 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -4 0 83 3948 282 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -4 0 84 3949 283 3 Te 1 5 0 0 1 F s 6.195 2 -4 0 1 3950 283 3 Te 2 5 0 0 2 F s 4.205 2 -4 0 2 3951 283 3 Te 3 5 1 -1 1 F py 8.156 2 -4 0 3 3952 283 3 Te 4 5 1 0 1 F pz 8.156 2 -4 0 4 3953 283 3 Te 5 5 1 1 1 F px 8.156 2 -4 0 5 3954 283 3 Te 6 5 1 -1 2 F py 5.009 2 -4 0 6 3955 283 3 Te 7 5 1 0 2 F pz 5.009 2 -4 0 7 3956 283 3 Te 8 5 1 1 2 F px 5.009 2 -4 0 8 3957 283 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -4 0 9 3958 283 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -4 0 10 3959 283 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -4 0 11 3960 283 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -4 0 12 3961 283 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -4 0 13 3962 284 3 Te 1 5 0 0 1 F s 6.195 2 -4 0 14 3963 284 3 Te 2 5 0 0 2 F s 4.205 2 -4 0 15 3964 284 3 Te 3 5 1 -1 1 F py 8.156 2 -4 0 16 3965 284 3 Te 4 5 1 0 1 F pz 8.156 2 -4 0 17 3966 284 3 Te 5 5 1 1 1 F px 8.156 2 -4 0 18 3967 284 3 Te 6 5 1 -1 2 F py 5.009 2 -4 0 19 3968 284 3 Te 7 5 1 0 2 F pz 5.009 2 -4 0 20 3969 284 3 Te 8 5 1 1 2 F px 5.009 2 -4 0 21 3970 284 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -4 0 22 3971 284 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -4 0 23 3972 284 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -4 0 24 3973 284 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -4 0 25 3974 284 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -4 0 26 3975 285 2 Ge 1 4 0 0 1 F s 6.581 2 -4 0 27 3976 285 2 Ge 2 4 0 0 2 F s 4.412 2 -4 0 28 3977 285 2 Ge 3 4 1 -1 1 F py 9.340 2 -4 0 29 3978 285 2 Ge 4 4 1 0 1 F pz 9.340 2 -4 0 30 3979 285 2 Ge 5 4 1 1 1 F px 9.340 2 -4 0 31 3980 285 2 Ge 6 4 1 -1 2 F py 5.665 2 -4 0 32 3981 285 2 Ge 7 4 1 0 2 F pz 5.665 2 -4 0 33 3982 285 2 Ge 8 4 1 1 2 F px 5.665 2 -4 0 34 3983 285 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 -4 0 35 3984 285 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 -4 0 36 3985 285 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 -4 0 37 3986 285 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 -4 0 38 3987 285 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 -4 0 39 3988 286 1 Fe 1 4 0 0 1 F s 9.649 2 -4 0 40 3989 286 1 Fe 2 4 0 0 2 F s 6.885 2 -4 0 41 3990 286 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -4 0 42 3991 286 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -4 0 43 3992 286 1 Fe 5 3 2 0 1 F dz2 6.632 2 -4 0 44 3993 286 1 Fe 6 3 2 1 1 F dxz 6.632 2 -4 0 45 3994 286 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -4 0 46 3995 286 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -4 0 47 3996 286 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -4 0 48 3997 286 1 Fe 10 3 2 0 2 F dz2 2.565 2 -4 0 49 3998 286 1 Fe 11 3 2 1 2 F dxz 2.565 2 -4 0 50 3999 286 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -4 0 51 4000 286 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -4 0 52 4001 286 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -4 0 53 4002 286 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -4 0 54 4003 287 1 Fe 1 4 0 0 1 F s 9.649 2 -4 0 55 4004 287 1 Fe 2 4 0 0 2 F s 6.885 2 -4 0 56 4005 287 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -4 0 57 4006 287 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -4 0 58 4007 287 1 Fe 5 3 2 0 1 F dz2 6.632 2 -4 0 59 4008 287 1 Fe 6 3 2 1 1 F dxz 6.632 2 -4 0 60 4009 287 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -4 0 61 4010 287 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -4 0 62 4011 287 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -4 0 63 4012 287 1 Fe 10 3 2 0 2 F dz2 2.565 2 -4 0 64 4013 287 1 Fe 11 3 2 1 2 F dxz 2.565 2 -4 0 65 4014 287 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -4 0 66 4015 287 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -4 0 67 4016 287 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -4 0 68 4017 287 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -4 0 69 4018 288 1 Fe 1 4 0 0 1 F s 9.649 2 -4 0 70 4019 288 1 Fe 2 4 0 0 2 F s 6.885 2 -4 0 71 4020 288 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -4 0 72 4021 288 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -4 0 73 4022 288 1 Fe 5 3 2 0 1 F dz2 6.632 2 -4 0 74 4023 288 1 Fe 6 3 2 1 1 F dxz 6.632 2 -4 0 75 4024 288 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -4 0 76 4025 288 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -4 0 77 4026 288 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -4 0 78 4027 288 1 Fe 10 3 2 0 2 F dz2 2.565 2 -4 0 79 4028 288 1 Fe 11 3 2 1 2 F dxz 2.565 2 -4 0 80 4029 288 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -4 0 81 4030 288 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -4 0 82 4031 288 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -4 0 83 4032 288 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -4 0 84 4033 289 3 Te 1 5 0 0 1 F s 6.195 3 -4 0 1 4034 289 3 Te 2 5 0 0 2 F s 4.205 3 -4 0 2 4035 289 3 Te 3 5 1 -1 1 F py 8.156 3 -4 0 3 4036 289 3 Te 4 5 1 0 1 F pz 8.156 3 -4 0 4 4037 289 3 Te 5 5 1 1 1 F px 8.156 3 -4 0 5 4038 289 3 Te 6 5 1 -1 2 F py 5.009 3 -4 0 6 4039 289 3 Te 7 5 1 0 2 F pz 5.009 3 -4 0 7 4040 289 3 Te 8 5 1 1 2 F px 5.009 3 -4 0 8 4041 289 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -4 0 9 4042 289 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -4 0 10 4043 289 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -4 0 11 4044 289 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -4 0 12 4045 289 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -4 0 13 4046 290 3 Te 1 5 0 0 1 F s 6.195 3 -4 0 14 4047 290 3 Te 2 5 0 0 2 F s 4.205 3 -4 0 15 4048 290 3 Te 3 5 1 -1 1 F py 8.156 3 -4 0 16 4049 290 3 Te 4 5 1 0 1 F pz 8.156 3 -4 0 17 4050 290 3 Te 5 5 1 1 1 F px 8.156 3 -4 0 18 4051 290 3 Te 6 5 1 -1 2 F py 5.009 3 -4 0 19 4052 290 3 Te 7 5 1 0 2 F pz 5.009 3 -4 0 20 4053 290 3 Te 8 5 1 1 2 F px 5.009 3 -4 0 21 4054 290 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -4 0 22 4055 290 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -4 0 23 4056 290 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -4 0 24 4057 290 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -4 0 25 4058 290 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -4 0 26 4059 291 2 Ge 1 4 0 0 1 F s 6.581 3 -4 0 27 4060 291 2 Ge 2 4 0 0 2 F s 4.412 3 -4 0 28 4061 291 2 Ge 3 4 1 -1 1 F py 9.340 3 -4 0 29 4062 291 2 Ge 4 4 1 0 1 F pz 9.340 3 -4 0 30 4063 291 2 Ge 5 4 1 1 1 F px 9.340 3 -4 0 31 4064 291 2 Ge 6 4 1 -1 2 F py 5.665 3 -4 0 32 4065 291 2 Ge 7 4 1 0 2 F pz 5.665 3 -4 0 33 4066 291 2 Ge 8 4 1 1 2 F px 5.665 3 -4 0 34 4067 291 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 -4 0 35 4068 291 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 -4 0 36 4069 291 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 -4 0 37 4070 291 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 -4 0 38 4071 291 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 -4 0 39 4072 292 1 Fe 1 4 0 0 1 F s 9.649 3 -4 0 40 4073 292 1 Fe 2 4 0 0 2 F s 6.885 3 -4 0 41 4074 292 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -4 0 42 4075 292 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -4 0 43 4076 292 1 Fe 5 3 2 0 1 F dz2 6.632 3 -4 0 44 4077 292 1 Fe 6 3 2 1 1 F dxz 6.632 3 -4 0 45 4078 292 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -4 0 46 4079 292 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -4 0 47 4080 292 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -4 0 48 4081 292 1 Fe 10 3 2 0 2 F dz2 2.565 3 -4 0 49 4082 292 1 Fe 11 3 2 1 2 F dxz 2.565 3 -4 0 50 4083 292 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -4 0 51 4084 292 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -4 0 52 4085 292 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -4 0 53 4086 292 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -4 0 54 4087 293 1 Fe 1 4 0 0 1 F s 9.649 3 -4 0 55 4088 293 1 Fe 2 4 0 0 2 F s 6.885 3 -4 0 56 4089 293 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -4 0 57 4090 293 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -4 0 58 4091 293 1 Fe 5 3 2 0 1 F dz2 6.632 3 -4 0 59 4092 293 1 Fe 6 3 2 1 1 F dxz 6.632 3 -4 0 60 4093 293 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -4 0 61 4094 293 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -4 0 62 4095 293 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -4 0 63 4096 293 1 Fe 10 3 2 0 2 F dz2 2.565 3 -4 0 64 4097 293 1 Fe 11 3 2 1 2 F dxz 2.565 3 -4 0 65 4098 293 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -4 0 66 4099 293 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -4 0 67 4100 293 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -4 0 68 4101 293 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -4 0 69 4102 294 1 Fe 1 4 0 0 1 F s 9.649 3 -4 0 70 4103 294 1 Fe 2 4 0 0 2 F s 6.885 3 -4 0 71 4104 294 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -4 0 72 4105 294 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -4 0 73 4106 294 1 Fe 5 3 2 0 1 F dz2 6.632 3 -4 0 74 4107 294 1 Fe 6 3 2 1 1 F dxz 6.632 3 -4 0 75 4108 294 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -4 0 76 4109 294 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -4 0 77 4110 294 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -4 0 78 4111 294 1 Fe 10 3 2 0 2 F dz2 2.565 3 -4 0 79 4112 294 1 Fe 11 3 2 1 2 F dxz 2.565 3 -4 0 80 4113 294 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -4 0 81 4114 294 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -4 0 82 4115 294 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -4 0 83 4116 294 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -4 0 84 4117 295 3 Te 1 5 0 0 1 F s 6.195 4 -4 0 1 4118 295 3 Te 2 5 0 0 2 F s 4.205 4 -4 0 2 4119 295 3 Te 3 5 1 -1 1 F py 8.156 4 -4 0 3 4120 295 3 Te 4 5 1 0 1 F pz 8.156 4 -4 0 4 4121 295 3 Te 5 5 1 1 1 F px 8.156 4 -4 0 5 4122 295 3 Te 6 5 1 -1 2 F py 5.009 4 -4 0 6 4123 295 3 Te 7 5 1 0 2 F pz 5.009 4 -4 0 7 4124 295 3 Te 8 5 1 1 2 F px 5.009 4 -4 0 8 4125 295 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -4 0 9 4126 295 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -4 0 10 4127 295 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -4 0 11 4128 295 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -4 0 12 4129 295 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -4 0 13 4130 296 3 Te 1 5 0 0 1 F s 6.195 4 -4 0 14 4131 296 3 Te 2 5 0 0 2 F s 4.205 4 -4 0 15 4132 296 3 Te 3 5 1 -1 1 F py 8.156 4 -4 0 16 4133 296 3 Te 4 5 1 0 1 F pz 8.156 4 -4 0 17 4134 296 3 Te 5 5 1 1 1 F px 8.156 4 -4 0 18 4135 296 3 Te 6 5 1 -1 2 F py 5.009 4 -4 0 19 4136 296 3 Te 7 5 1 0 2 F pz 5.009 4 -4 0 20 4137 296 3 Te 8 5 1 1 2 F px 5.009 4 -4 0 21 4138 296 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -4 0 22 4139 296 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -4 0 23 4140 296 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -4 0 24 4141 296 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -4 0 25 4142 296 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -4 0 26 4143 297 2 Ge 1 4 0 0 1 F s 6.581 4 -4 0 27 4144 297 2 Ge 2 4 0 0 2 F s 4.412 4 -4 0 28 4145 297 2 Ge 3 4 1 -1 1 F py 9.340 4 -4 0 29 4146 297 2 Ge 4 4 1 0 1 F pz 9.340 4 -4 0 30 4147 297 2 Ge 5 4 1 1 1 F px 9.340 4 -4 0 31 4148 297 2 Ge 6 4 1 -1 2 F py 5.665 4 -4 0 32 4149 297 2 Ge 7 4 1 0 2 F pz 5.665 4 -4 0 33 4150 297 2 Ge 8 4 1 1 2 F px 5.665 4 -4 0 34 4151 297 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 -4 0 35 4152 297 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 -4 0 36 4153 297 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 -4 0 37 4154 297 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 -4 0 38 4155 297 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 -4 0 39 4156 298 1 Fe 1 4 0 0 1 F s 9.649 4 -4 0 40 4157 298 1 Fe 2 4 0 0 2 F s 6.885 4 -4 0 41 4158 298 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -4 0 42 4159 298 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -4 0 43 4160 298 1 Fe 5 3 2 0 1 F dz2 6.632 4 -4 0 44 4161 298 1 Fe 6 3 2 1 1 F dxz 6.632 4 -4 0 45 4162 298 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -4 0 46 4163 298 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -4 0 47 4164 298 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -4 0 48 4165 298 1 Fe 10 3 2 0 2 F dz2 2.565 4 -4 0 49 4166 298 1 Fe 11 3 2 1 2 F dxz 2.565 4 -4 0 50 4167 298 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -4 0 51 4168 298 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -4 0 52 4169 298 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -4 0 53 4170 298 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -4 0 54 4171 299 1 Fe 1 4 0 0 1 F s 9.649 4 -4 0 55 4172 299 1 Fe 2 4 0 0 2 F s 6.885 4 -4 0 56 4173 299 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -4 0 57 4174 299 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -4 0 58 4175 299 1 Fe 5 3 2 0 1 F dz2 6.632 4 -4 0 59 4176 299 1 Fe 6 3 2 1 1 F dxz 6.632 4 -4 0 60 4177 299 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -4 0 61 4178 299 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -4 0 62 4179 299 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -4 0 63 4180 299 1 Fe 10 3 2 0 2 F dz2 2.565 4 -4 0 64 4181 299 1 Fe 11 3 2 1 2 F dxz 2.565 4 -4 0 65 4182 299 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -4 0 66 4183 299 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -4 0 67 4184 299 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -4 0 68 4185 299 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -4 0 69 4186 300 1 Fe 1 4 0 0 1 F s 9.649 4 -4 0 70 4187 300 1 Fe 2 4 0 0 2 F s 6.885 4 -4 0 71 4188 300 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -4 0 72 4189 300 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -4 0 73 4190 300 1 Fe 5 3 2 0 1 F dz2 6.632 4 -4 0 74 4191 300 1 Fe 6 3 2 1 1 F dxz 6.632 4 -4 0 75 4192 300 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -4 0 76 4193 300 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -4 0 77 4194 300 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -4 0 78 4195 300 1 Fe 10 3 2 0 2 F dz2 2.565 4 -4 0 79 4196 300 1 Fe 11 3 2 1 2 F dxz 2.565 4 -4 0 80 4197 300 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -4 0 81 4198 300 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -4 0 82 4199 300 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -4 0 83 4200 300 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -4 0 84 4201 301 3 Te 1 5 0 0 1 F s 6.195 -4 -4 0 1 4202 301 3 Te 2 5 0 0 2 F s 4.205 -4 -4 0 2 4203 301 3 Te 3 5 1 -1 1 F py 8.156 -4 -4 0 3 4204 301 3 Te 4 5 1 0 1 F pz 8.156 -4 -4 0 4 4205 301 3 Te 5 5 1 1 1 F px 8.156 -4 -4 0 5 4206 301 3 Te 6 5 1 -1 2 F py 5.009 -4 -4 0 6 4207 301 3 Te 7 5 1 0 2 F pz 5.009 -4 -4 0 7 4208 301 3 Te 8 5 1 1 2 F px 5.009 -4 -4 0 8 4209 301 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -4 0 9 4210 301 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -4 0 10 4211 301 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -4 0 11 4212 301 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -4 0 12 4213 301 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -4 0 13 4214 302 3 Te 1 5 0 0 1 F s 6.195 -4 -4 0 14 4215 302 3 Te 2 5 0 0 2 F s 4.205 -4 -4 0 15 4216 302 3 Te 3 5 1 -1 1 F py 8.156 -4 -4 0 16 4217 302 3 Te 4 5 1 0 1 F pz 8.156 -4 -4 0 17 4218 302 3 Te 5 5 1 1 1 F px 8.156 -4 -4 0 18 4219 302 3 Te 6 5 1 -1 2 F py 5.009 -4 -4 0 19 4220 302 3 Te 7 5 1 0 2 F pz 5.009 -4 -4 0 20 4221 302 3 Te 8 5 1 1 2 F px 5.009 -4 -4 0 21 4222 302 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -4 0 22 4223 302 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -4 0 23 4224 302 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -4 0 24 4225 302 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -4 0 25 4226 302 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -4 0 26 4227 303 2 Ge 1 4 0 0 1 F s 6.581 -4 -4 0 27 4228 303 2 Ge 2 4 0 0 2 F s 4.412 -4 -4 0 28 4229 303 2 Ge 3 4 1 -1 1 F py 9.340 -4 -4 0 29 4230 303 2 Ge 4 4 1 0 1 F pz 9.340 -4 -4 0 30 4231 303 2 Ge 5 4 1 1 1 F px 9.340 -4 -4 0 31 4232 303 2 Ge 6 4 1 -1 2 F py 5.665 -4 -4 0 32 4233 303 2 Ge 7 4 1 0 2 F pz 5.665 -4 -4 0 33 4234 303 2 Ge 8 4 1 1 2 F px 5.665 -4 -4 0 34 4235 303 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 -4 0 35 4236 303 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 -4 0 36 4237 303 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 -4 0 37 4238 303 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 -4 0 38 4239 303 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 -4 0 39 4240 304 1 Fe 1 4 0 0 1 F s 9.649 -4 -4 0 40 4241 304 1 Fe 2 4 0 0 2 F s 6.885 -4 -4 0 41 4242 304 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -4 0 42 4243 304 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -4 0 43 4244 304 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -4 0 44 4245 304 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -4 0 45 4246 304 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -4 0 46 4247 304 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -4 0 47 4248 304 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -4 0 48 4249 304 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -4 0 49 4250 304 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -4 0 50 4251 304 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -4 0 51 4252 304 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -4 0 52 4253 304 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -4 0 53 4254 304 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -4 0 54 4255 305 1 Fe 1 4 0 0 1 F s 9.649 -4 -4 0 55 4256 305 1 Fe 2 4 0 0 2 F s 6.885 -4 -4 0 56 4257 305 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -4 0 57 4258 305 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -4 0 58 4259 305 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -4 0 59 4260 305 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -4 0 60 4261 305 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -4 0 61 4262 305 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -4 0 62 4263 305 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -4 0 63 4264 305 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -4 0 64 4265 305 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -4 0 65 4266 305 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -4 0 66 4267 305 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -4 0 67 4268 305 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -4 0 68 4269 305 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -4 0 69 4270 306 1 Fe 1 4 0 0 1 F s 9.649 -4 -4 0 70 4271 306 1 Fe 2 4 0 0 2 F s 6.885 -4 -4 0 71 4272 306 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -4 0 72 4273 306 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -4 0 73 4274 306 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -4 0 74 4275 306 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -4 0 75 4276 306 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -4 0 76 4277 306 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -4 0 77 4278 306 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -4 0 78 4279 306 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -4 0 79 4280 306 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -4 0 80 4281 306 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -4 0 81 4282 306 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -4 0 82 4283 306 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -4 0 83 4284 306 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -4 0 84 4285 307 3 Te 1 5 0 0 1 F s 6.195 -3 -4 0 1 4286 307 3 Te 2 5 0 0 2 F s 4.205 -3 -4 0 2 4287 307 3 Te 3 5 1 -1 1 F py 8.156 -3 -4 0 3 4288 307 3 Te 4 5 1 0 1 F pz 8.156 -3 -4 0 4 4289 307 3 Te 5 5 1 1 1 F px 8.156 -3 -4 0 5 4290 307 3 Te 6 5 1 -1 2 F py 5.009 -3 -4 0 6 4291 307 3 Te 7 5 1 0 2 F pz 5.009 -3 -4 0 7 4292 307 3 Te 8 5 1 1 2 F px 5.009 -3 -4 0 8 4293 307 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -4 0 9 4294 307 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -4 0 10 4295 307 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -4 0 11 4296 307 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -4 0 12 4297 307 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -4 0 13 4298 308 3 Te 1 5 0 0 1 F s 6.195 -3 -4 0 14 4299 308 3 Te 2 5 0 0 2 F s 4.205 -3 -4 0 15 4300 308 3 Te 3 5 1 -1 1 F py 8.156 -3 -4 0 16 4301 308 3 Te 4 5 1 0 1 F pz 8.156 -3 -4 0 17 4302 308 3 Te 5 5 1 1 1 F px 8.156 -3 -4 0 18 4303 308 3 Te 6 5 1 -1 2 F py 5.009 -3 -4 0 19 4304 308 3 Te 7 5 1 0 2 F pz 5.009 -3 -4 0 20 4305 308 3 Te 8 5 1 1 2 F px 5.009 -3 -4 0 21 4306 308 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -4 0 22 4307 308 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -4 0 23 4308 308 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -4 0 24 4309 308 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -4 0 25 4310 308 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -4 0 26 4311 309 2 Ge 1 4 0 0 1 F s 6.581 -3 -4 0 27 4312 309 2 Ge 2 4 0 0 2 F s 4.412 -3 -4 0 28 4313 309 2 Ge 3 4 1 -1 1 F py 9.340 -3 -4 0 29 4314 309 2 Ge 4 4 1 0 1 F pz 9.340 -3 -4 0 30 4315 309 2 Ge 5 4 1 1 1 F px 9.340 -3 -4 0 31 4316 309 2 Ge 6 4 1 -1 2 F py 5.665 -3 -4 0 32 4317 309 2 Ge 7 4 1 0 2 F pz 5.665 -3 -4 0 33 4318 309 2 Ge 8 4 1 1 2 F px 5.665 -3 -4 0 34 4319 309 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 -4 0 35 4320 309 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 -4 0 36 4321 309 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 -4 0 37 4322 309 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 -4 0 38 4323 309 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 -4 0 39 4324 310 1 Fe 1 4 0 0 1 F s 9.649 -3 -4 0 40 4325 310 1 Fe 2 4 0 0 2 F s 6.885 -3 -4 0 41 4326 310 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -4 0 42 4327 310 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -4 0 43 4328 310 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -4 0 44 4329 310 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -4 0 45 4330 310 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -4 0 46 4331 310 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -4 0 47 4332 310 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -4 0 48 4333 310 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -4 0 49 4334 310 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -4 0 50 4335 310 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -4 0 51 4336 310 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -4 0 52 4337 310 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -4 0 53 4338 310 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -4 0 54 4339 311 1 Fe 1 4 0 0 1 F s 9.649 -3 -4 0 55 4340 311 1 Fe 2 4 0 0 2 F s 6.885 -3 -4 0 56 4341 311 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -4 0 57 4342 311 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -4 0 58 4343 311 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -4 0 59 4344 311 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -4 0 60 4345 311 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -4 0 61 4346 311 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -4 0 62 4347 311 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -4 0 63 4348 311 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -4 0 64 4349 311 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -4 0 65 4350 311 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -4 0 66 4351 311 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -4 0 67 4352 311 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -4 0 68 4353 311 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -4 0 69 4354 312 1 Fe 1 4 0 0 1 F s 9.649 -3 -4 0 70 4355 312 1 Fe 2 4 0 0 2 F s 6.885 -3 -4 0 71 4356 312 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -4 0 72 4357 312 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -4 0 73 4358 312 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -4 0 74 4359 312 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -4 0 75 4360 312 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -4 0 76 4361 312 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -4 0 77 4362 312 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -4 0 78 4363 312 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -4 0 79 4364 312 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -4 0 80 4365 312 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -4 0 81 4366 312 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -4 0 82 4367 312 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -4 0 83 4368 312 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -4 0 84 4369 313 3 Te 1 5 0 0 1 F s 6.195 -2 -4 0 1 4370 313 3 Te 2 5 0 0 2 F s 4.205 -2 -4 0 2 4371 313 3 Te 3 5 1 -1 1 F py 8.156 -2 -4 0 3 4372 313 3 Te 4 5 1 0 1 F pz 8.156 -2 -4 0 4 4373 313 3 Te 5 5 1 1 1 F px 8.156 -2 -4 0 5 4374 313 3 Te 6 5 1 -1 2 F py 5.009 -2 -4 0 6 4375 313 3 Te 7 5 1 0 2 F pz 5.009 -2 -4 0 7 4376 313 3 Te 8 5 1 1 2 F px 5.009 -2 -4 0 8 4377 313 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -4 0 9 4378 313 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -4 0 10 4379 313 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -4 0 11 4380 313 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -4 0 12 4381 313 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -4 0 13 4382 314 3 Te 1 5 0 0 1 F s 6.195 -2 -4 0 14 4383 314 3 Te 2 5 0 0 2 F s 4.205 -2 -4 0 15 4384 314 3 Te 3 5 1 -1 1 F py 8.156 -2 -4 0 16 4385 314 3 Te 4 5 1 0 1 F pz 8.156 -2 -4 0 17 4386 314 3 Te 5 5 1 1 1 F px 8.156 -2 -4 0 18 4387 314 3 Te 6 5 1 -1 2 F py 5.009 -2 -4 0 19 4388 314 3 Te 7 5 1 0 2 F pz 5.009 -2 -4 0 20 4389 314 3 Te 8 5 1 1 2 F px 5.009 -2 -4 0 21 4390 314 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -4 0 22 4391 314 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -4 0 23 4392 314 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -4 0 24 4393 314 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -4 0 25 4394 314 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -4 0 26 4395 315 2 Ge 1 4 0 0 1 F s 6.581 -2 -4 0 27 4396 315 2 Ge 2 4 0 0 2 F s 4.412 -2 -4 0 28 4397 315 2 Ge 3 4 1 -1 1 F py 9.340 -2 -4 0 29 4398 315 2 Ge 4 4 1 0 1 F pz 9.340 -2 -4 0 30 4399 315 2 Ge 5 4 1 1 1 F px 9.340 -2 -4 0 31 4400 315 2 Ge 6 4 1 -1 2 F py 5.665 -2 -4 0 32 4401 315 2 Ge 7 4 1 0 2 F pz 5.665 -2 -4 0 33 4402 315 2 Ge 8 4 1 1 2 F px 5.665 -2 -4 0 34 4403 315 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 -4 0 35 4404 315 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 -4 0 36 4405 315 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 -4 0 37 4406 315 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 -4 0 38 4407 315 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 -4 0 39 4408 316 1 Fe 1 4 0 0 1 F s 9.649 -2 -4 0 40 4409 316 1 Fe 2 4 0 0 2 F s 6.885 -2 -4 0 41 4410 316 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -4 0 42 4411 316 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -4 0 43 4412 316 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -4 0 44 4413 316 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -4 0 45 4414 316 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -4 0 46 4415 316 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -4 0 47 4416 316 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -4 0 48 4417 316 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -4 0 49 4418 316 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -4 0 50 4419 316 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -4 0 51 4420 316 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -4 0 52 4421 316 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -4 0 53 4422 316 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -4 0 54 4423 317 1 Fe 1 4 0 0 1 F s 9.649 -2 -4 0 55 4424 317 1 Fe 2 4 0 0 2 F s 6.885 -2 -4 0 56 4425 317 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -4 0 57 4426 317 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -4 0 58 4427 317 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -4 0 59 4428 317 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -4 0 60 4429 317 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -4 0 61 4430 317 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -4 0 62 4431 317 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -4 0 63 4432 317 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -4 0 64 4433 317 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -4 0 65 4434 317 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -4 0 66 4435 317 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -4 0 67 4436 317 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -4 0 68 4437 317 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -4 0 69 4438 318 1 Fe 1 4 0 0 1 F s 9.649 -2 -4 0 70 4439 318 1 Fe 2 4 0 0 2 F s 6.885 -2 -4 0 71 4440 318 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -4 0 72 4441 318 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -4 0 73 4442 318 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -4 0 74 4443 318 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -4 0 75 4444 318 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -4 0 76 4445 318 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -4 0 77 4446 318 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -4 0 78 4447 318 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -4 0 79 4448 318 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -4 0 80 4449 318 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -4 0 81 4450 318 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -4 0 82 4451 318 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -4 0 83 4452 318 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -4 0 84 4453 319 3 Te 1 5 0 0 1 F s 6.195 -1 -4 0 1 4454 319 3 Te 2 5 0 0 2 F s 4.205 -1 -4 0 2 4455 319 3 Te 3 5 1 -1 1 F py 8.156 -1 -4 0 3 4456 319 3 Te 4 5 1 0 1 F pz 8.156 -1 -4 0 4 4457 319 3 Te 5 5 1 1 1 F px 8.156 -1 -4 0 5 4458 319 3 Te 6 5 1 -1 2 F py 5.009 -1 -4 0 6 4459 319 3 Te 7 5 1 0 2 F pz 5.009 -1 -4 0 7 4460 319 3 Te 8 5 1 1 2 F px 5.009 -1 -4 0 8 4461 319 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -4 0 9 4462 319 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -4 0 10 4463 319 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -4 0 11 4464 319 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -4 0 12 4465 319 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -4 0 13 4466 320 3 Te 1 5 0 0 1 F s 6.195 -1 -4 0 14 4467 320 3 Te 2 5 0 0 2 F s 4.205 -1 -4 0 15 4468 320 3 Te 3 5 1 -1 1 F py 8.156 -1 -4 0 16 4469 320 3 Te 4 5 1 0 1 F pz 8.156 -1 -4 0 17 4470 320 3 Te 5 5 1 1 1 F px 8.156 -1 -4 0 18 4471 320 3 Te 6 5 1 -1 2 F py 5.009 -1 -4 0 19 4472 320 3 Te 7 5 1 0 2 F pz 5.009 -1 -4 0 20 4473 320 3 Te 8 5 1 1 2 F px 5.009 -1 -4 0 21 4474 320 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -4 0 22 4475 320 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -4 0 23 4476 320 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -4 0 24 4477 320 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -4 0 25 4478 320 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -4 0 26 4479 321 2 Ge 1 4 0 0 1 F s 6.581 -1 -4 0 27 4480 321 2 Ge 2 4 0 0 2 F s 4.412 -1 -4 0 28 4481 321 2 Ge 3 4 1 -1 1 F py 9.340 -1 -4 0 29 4482 321 2 Ge 4 4 1 0 1 F pz 9.340 -1 -4 0 30 4483 321 2 Ge 5 4 1 1 1 F px 9.340 -1 -4 0 31 4484 321 2 Ge 6 4 1 -1 2 F py 5.665 -1 -4 0 32 4485 321 2 Ge 7 4 1 0 2 F pz 5.665 -1 -4 0 33 4486 321 2 Ge 8 4 1 1 2 F px 5.665 -1 -4 0 34 4487 321 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 -4 0 35 4488 321 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 -4 0 36 4489 321 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 -4 0 37 4490 321 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 -4 0 38 4491 321 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 -4 0 39 4492 322 1 Fe 1 4 0 0 1 F s 9.649 -1 -4 0 40 4493 322 1 Fe 2 4 0 0 2 F s 6.885 -1 -4 0 41 4494 322 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -4 0 42 4495 322 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -4 0 43 4496 322 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -4 0 44 4497 322 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -4 0 45 4498 322 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -4 0 46 4499 322 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -4 0 47 4500 322 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -4 0 48 4501 322 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -4 0 49 4502 322 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -4 0 50 4503 322 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -4 0 51 4504 322 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -4 0 52 4505 322 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -4 0 53 4506 322 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -4 0 54 4507 323 1 Fe 1 4 0 0 1 F s 9.649 -1 -4 0 55 4508 323 1 Fe 2 4 0 0 2 F s 6.885 -1 -4 0 56 4509 323 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -4 0 57 4510 323 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -4 0 58 4511 323 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -4 0 59 4512 323 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -4 0 60 4513 323 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -4 0 61 4514 323 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -4 0 62 4515 323 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -4 0 63 4516 323 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -4 0 64 4517 323 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -4 0 65 4518 323 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -4 0 66 4519 323 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -4 0 67 4520 323 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -4 0 68 4521 323 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -4 0 69 4522 324 1 Fe 1 4 0 0 1 F s 9.649 -1 -4 0 70 4523 324 1 Fe 2 4 0 0 2 F s 6.885 -1 -4 0 71 4524 324 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -4 0 72 4525 324 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -4 0 73 4526 324 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -4 0 74 4527 324 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -4 0 75 4528 324 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -4 0 76 4529 324 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -4 0 77 4530 324 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -4 0 78 4531 324 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -4 0 79 4532 324 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -4 0 80 4533 324 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -4 0 81 4534 324 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -4 0 82 4535 324 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -4 0 83 4536 324 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -4 0 84 4537 325 3 Te 1 5 0 0 1 F s 6.195 0 -3 0 1 4538 325 3 Te 2 5 0 0 2 F s 4.205 0 -3 0 2 4539 325 3 Te 3 5 1 -1 1 F py 8.156 0 -3 0 3 4540 325 3 Te 4 5 1 0 1 F pz 8.156 0 -3 0 4 4541 325 3 Te 5 5 1 1 1 F px 8.156 0 -3 0 5 4542 325 3 Te 6 5 1 -1 2 F py 5.009 0 -3 0 6 4543 325 3 Te 7 5 1 0 2 F pz 5.009 0 -3 0 7 4544 325 3 Te 8 5 1 1 2 F px 5.009 0 -3 0 8 4545 325 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -3 0 9 4546 325 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -3 0 10 4547 325 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -3 0 11 4548 325 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -3 0 12 4549 325 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -3 0 13 4550 326 3 Te 1 5 0 0 1 F s 6.195 0 -3 0 14 4551 326 3 Te 2 5 0 0 2 F s 4.205 0 -3 0 15 4552 326 3 Te 3 5 1 -1 1 F py 8.156 0 -3 0 16 4553 326 3 Te 4 5 1 0 1 F pz 8.156 0 -3 0 17 4554 326 3 Te 5 5 1 1 1 F px 8.156 0 -3 0 18 4555 326 3 Te 6 5 1 -1 2 F py 5.009 0 -3 0 19 4556 326 3 Te 7 5 1 0 2 F pz 5.009 0 -3 0 20 4557 326 3 Te 8 5 1 1 2 F px 5.009 0 -3 0 21 4558 326 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -3 0 22 4559 326 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -3 0 23 4560 326 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -3 0 24 4561 326 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -3 0 25 4562 326 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -3 0 26 4563 327 2 Ge 1 4 0 0 1 F s 6.581 0 -3 0 27 4564 327 2 Ge 2 4 0 0 2 F s 4.412 0 -3 0 28 4565 327 2 Ge 3 4 1 -1 1 F py 9.340 0 -3 0 29 4566 327 2 Ge 4 4 1 0 1 F pz 9.340 0 -3 0 30 4567 327 2 Ge 5 4 1 1 1 F px 9.340 0 -3 0 31 4568 327 2 Ge 6 4 1 -1 2 F py 5.665 0 -3 0 32 4569 327 2 Ge 7 4 1 0 2 F pz 5.665 0 -3 0 33 4570 327 2 Ge 8 4 1 1 2 F px 5.665 0 -3 0 34 4571 327 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 -3 0 35 4572 327 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 -3 0 36 4573 327 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 -3 0 37 4574 327 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 -3 0 38 4575 327 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 -3 0 39 4576 328 1 Fe 1 4 0 0 1 F s 9.649 0 -3 0 40 4577 328 1 Fe 2 4 0 0 2 F s 6.885 0 -3 0 41 4578 328 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -3 0 42 4579 328 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -3 0 43 4580 328 1 Fe 5 3 2 0 1 F dz2 6.632 0 -3 0 44 4581 328 1 Fe 6 3 2 1 1 F dxz 6.632 0 -3 0 45 4582 328 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -3 0 46 4583 328 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -3 0 47 4584 328 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -3 0 48 4585 328 1 Fe 10 3 2 0 2 F dz2 2.565 0 -3 0 49 4586 328 1 Fe 11 3 2 1 2 F dxz 2.565 0 -3 0 50 4587 328 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -3 0 51 4588 328 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -3 0 52 4589 328 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -3 0 53 4590 328 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -3 0 54 4591 329 1 Fe 1 4 0 0 1 F s 9.649 0 -3 0 55 4592 329 1 Fe 2 4 0 0 2 F s 6.885 0 -3 0 56 4593 329 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -3 0 57 4594 329 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -3 0 58 4595 329 1 Fe 5 3 2 0 1 F dz2 6.632 0 -3 0 59 4596 329 1 Fe 6 3 2 1 1 F dxz 6.632 0 -3 0 60 4597 329 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -3 0 61 4598 329 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -3 0 62 4599 329 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -3 0 63 4600 329 1 Fe 10 3 2 0 2 F dz2 2.565 0 -3 0 64 4601 329 1 Fe 11 3 2 1 2 F dxz 2.565 0 -3 0 65 4602 329 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -3 0 66 4603 329 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -3 0 67 4604 329 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -3 0 68 4605 329 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -3 0 69 4606 330 1 Fe 1 4 0 0 1 F s 9.649 0 -3 0 70 4607 330 1 Fe 2 4 0 0 2 F s 6.885 0 -3 0 71 4608 330 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -3 0 72 4609 330 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -3 0 73 4610 330 1 Fe 5 3 2 0 1 F dz2 6.632 0 -3 0 74 4611 330 1 Fe 6 3 2 1 1 F dxz 6.632 0 -3 0 75 4612 330 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -3 0 76 4613 330 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -3 0 77 4614 330 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -3 0 78 4615 330 1 Fe 10 3 2 0 2 F dz2 2.565 0 -3 0 79 4616 330 1 Fe 11 3 2 1 2 F dxz 2.565 0 -3 0 80 4617 330 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -3 0 81 4618 330 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -3 0 82 4619 330 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -3 0 83 4620 330 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -3 0 84 4621 331 3 Te 1 5 0 0 1 F s 6.195 1 -3 0 1 4622 331 3 Te 2 5 0 0 2 F s 4.205 1 -3 0 2 4623 331 3 Te 3 5 1 -1 1 F py 8.156 1 -3 0 3 4624 331 3 Te 4 5 1 0 1 F pz 8.156 1 -3 0 4 4625 331 3 Te 5 5 1 1 1 F px 8.156 1 -3 0 5 4626 331 3 Te 6 5 1 -1 2 F py 5.009 1 -3 0 6 4627 331 3 Te 7 5 1 0 2 F pz 5.009 1 -3 0 7 4628 331 3 Te 8 5 1 1 2 F px 5.009 1 -3 0 8 4629 331 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -3 0 9 4630 331 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -3 0 10 4631 331 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -3 0 11 4632 331 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -3 0 12 4633 331 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -3 0 13 4634 332 3 Te 1 5 0 0 1 F s 6.195 1 -3 0 14 4635 332 3 Te 2 5 0 0 2 F s 4.205 1 -3 0 15 4636 332 3 Te 3 5 1 -1 1 F py 8.156 1 -3 0 16 4637 332 3 Te 4 5 1 0 1 F pz 8.156 1 -3 0 17 4638 332 3 Te 5 5 1 1 1 F px 8.156 1 -3 0 18 4639 332 3 Te 6 5 1 -1 2 F py 5.009 1 -3 0 19 4640 332 3 Te 7 5 1 0 2 F pz 5.009 1 -3 0 20 4641 332 3 Te 8 5 1 1 2 F px 5.009 1 -3 0 21 4642 332 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -3 0 22 4643 332 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -3 0 23 4644 332 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -3 0 24 4645 332 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -3 0 25 4646 332 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -3 0 26 4647 333 2 Ge 1 4 0 0 1 F s 6.581 1 -3 0 27 4648 333 2 Ge 2 4 0 0 2 F s 4.412 1 -3 0 28 4649 333 2 Ge 3 4 1 -1 1 F py 9.340 1 -3 0 29 4650 333 2 Ge 4 4 1 0 1 F pz 9.340 1 -3 0 30 4651 333 2 Ge 5 4 1 1 1 F px 9.340 1 -3 0 31 4652 333 2 Ge 6 4 1 -1 2 F py 5.665 1 -3 0 32 4653 333 2 Ge 7 4 1 0 2 F pz 5.665 1 -3 0 33 4654 333 2 Ge 8 4 1 1 2 F px 5.665 1 -3 0 34 4655 333 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 -3 0 35 4656 333 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 -3 0 36 4657 333 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 -3 0 37 4658 333 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 -3 0 38 4659 333 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 -3 0 39 4660 334 1 Fe 1 4 0 0 1 F s 9.649 1 -3 0 40 4661 334 1 Fe 2 4 0 0 2 F s 6.885 1 -3 0 41 4662 334 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -3 0 42 4663 334 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -3 0 43 4664 334 1 Fe 5 3 2 0 1 F dz2 6.632 1 -3 0 44 4665 334 1 Fe 6 3 2 1 1 F dxz 6.632 1 -3 0 45 4666 334 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -3 0 46 4667 334 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -3 0 47 4668 334 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -3 0 48 4669 334 1 Fe 10 3 2 0 2 F dz2 2.565 1 -3 0 49 4670 334 1 Fe 11 3 2 1 2 F dxz 2.565 1 -3 0 50 4671 334 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -3 0 51 4672 334 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -3 0 52 4673 334 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -3 0 53 4674 334 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -3 0 54 4675 335 1 Fe 1 4 0 0 1 F s 9.649 1 -3 0 55 4676 335 1 Fe 2 4 0 0 2 F s 6.885 1 -3 0 56 4677 335 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -3 0 57 4678 335 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -3 0 58 4679 335 1 Fe 5 3 2 0 1 F dz2 6.632 1 -3 0 59 4680 335 1 Fe 6 3 2 1 1 F dxz 6.632 1 -3 0 60 4681 335 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -3 0 61 4682 335 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -3 0 62 4683 335 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -3 0 63 4684 335 1 Fe 10 3 2 0 2 F dz2 2.565 1 -3 0 64 4685 335 1 Fe 11 3 2 1 2 F dxz 2.565 1 -3 0 65 4686 335 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -3 0 66 4687 335 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -3 0 67 4688 335 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -3 0 68 4689 335 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -3 0 69 4690 336 1 Fe 1 4 0 0 1 F s 9.649 1 -3 0 70 4691 336 1 Fe 2 4 0 0 2 F s 6.885 1 -3 0 71 4692 336 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -3 0 72 4693 336 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -3 0 73 4694 336 1 Fe 5 3 2 0 1 F dz2 6.632 1 -3 0 74 4695 336 1 Fe 6 3 2 1 1 F dxz 6.632 1 -3 0 75 4696 336 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -3 0 76 4697 336 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -3 0 77 4698 336 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -3 0 78 4699 336 1 Fe 10 3 2 0 2 F dz2 2.565 1 -3 0 79 4700 336 1 Fe 11 3 2 1 2 F dxz 2.565 1 -3 0 80 4701 336 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -3 0 81 4702 336 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -3 0 82 4703 336 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -3 0 83 4704 336 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -3 0 84 4705 337 3 Te 1 5 0 0 1 F s 6.195 2 -3 0 1 4706 337 3 Te 2 5 0 0 2 F s 4.205 2 -3 0 2 4707 337 3 Te 3 5 1 -1 1 F py 8.156 2 -3 0 3 4708 337 3 Te 4 5 1 0 1 F pz 8.156 2 -3 0 4 4709 337 3 Te 5 5 1 1 1 F px 8.156 2 -3 0 5 4710 337 3 Te 6 5 1 -1 2 F py 5.009 2 -3 0 6 4711 337 3 Te 7 5 1 0 2 F pz 5.009 2 -3 0 7 4712 337 3 Te 8 5 1 1 2 F px 5.009 2 -3 0 8 4713 337 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -3 0 9 4714 337 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -3 0 10 4715 337 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -3 0 11 4716 337 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -3 0 12 4717 337 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -3 0 13 4718 338 3 Te 1 5 0 0 1 F s 6.195 2 -3 0 14 4719 338 3 Te 2 5 0 0 2 F s 4.205 2 -3 0 15 4720 338 3 Te 3 5 1 -1 1 F py 8.156 2 -3 0 16 4721 338 3 Te 4 5 1 0 1 F pz 8.156 2 -3 0 17 4722 338 3 Te 5 5 1 1 1 F px 8.156 2 -3 0 18 4723 338 3 Te 6 5 1 -1 2 F py 5.009 2 -3 0 19 4724 338 3 Te 7 5 1 0 2 F pz 5.009 2 -3 0 20 4725 338 3 Te 8 5 1 1 2 F px 5.009 2 -3 0 21 4726 338 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -3 0 22 4727 338 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -3 0 23 4728 338 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -3 0 24 4729 338 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -3 0 25 4730 338 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -3 0 26 4731 339 2 Ge 1 4 0 0 1 F s 6.581 2 -3 0 27 4732 339 2 Ge 2 4 0 0 2 F s 4.412 2 -3 0 28 4733 339 2 Ge 3 4 1 -1 1 F py 9.340 2 -3 0 29 4734 339 2 Ge 4 4 1 0 1 F pz 9.340 2 -3 0 30 4735 339 2 Ge 5 4 1 1 1 F px 9.340 2 -3 0 31 4736 339 2 Ge 6 4 1 -1 2 F py 5.665 2 -3 0 32 4737 339 2 Ge 7 4 1 0 2 F pz 5.665 2 -3 0 33 4738 339 2 Ge 8 4 1 1 2 F px 5.665 2 -3 0 34 4739 339 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 -3 0 35 4740 339 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 -3 0 36 4741 339 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 -3 0 37 4742 339 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 -3 0 38 4743 339 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 -3 0 39 4744 340 1 Fe 1 4 0 0 1 F s 9.649 2 -3 0 40 4745 340 1 Fe 2 4 0 0 2 F s 6.885 2 -3 0 41 4746 340 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -3 0 42 4747 340 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -3 0 43 4748 340 1 Fe 5 3 2 0 1 F dz2 6.632 2 -3 0 44 4749 340 1 Fe 6 3 2 1 1 F dxz 6.632 2 -3 0 45 4750 340 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -3 0 46 4751 340 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -3 0 47 4752 340 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -3 0 48 4753 340 1 Fe 10 3 2 0 2 F dz2 2.565 2 -3 0 49 4754 340 1 Fe 11 3 2 1 2 F dxz 2.565 2 -3 0 50 4755 340 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -3 0 51 4756 340 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -3 0 52 4757 340 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -3 0 53 4758 340 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -3 0 54 4759 341 1 Fe 1 4 0 0 1 F s 9.649 2 -3 0 55 4760 341 1 Fe 2 4 0 0 2 F s 6.885 2 -3 0 56 4761 341 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -3 0 57 4762 341 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -3 0 58 4763 341 1 Fe 5 3 2 0 1 F dz2 6.632 2 -3 0 59 4764 341 1 Fe 6 3 2 1 1 F dxz 6.632 2 -3 0 60 4765 341 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -3 0 61 4766 341 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -3 0 62 4767 341 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -3 0 63 4768 341 1 Fe 10 3 2 0 2 F dz2 2.565 2 -3 0 64 4769 341 1 Fe 11 3 2 1 2 F dxz 2.565 2 -3 0 65 4770 341 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -3 0 66 4771 341 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -3 0 67 4772 341 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -3 0 68 4773 341 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -3 0 69 4774 342 1 Fe 1 4 0 0 1 F s 9.649 2 -3 0 70 4775 342 1 Fe 2 4 0 0 2 F s 6.885 2 -3 0 71 4776 342 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -3 0 72 4777 342 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -3 0 73 4778 342 1 Fe 5 3 2 0 1 F dz2 6.632 2 -3 0 74 4779 342 1 Fe 6 3 2 1 1 F dxz 6.632 2 -3 0 75 4780 342 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -3 0 76 4781 342 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -3 0 77 4782 342 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -3 0 78 4783 342 1 Fe 10 3 2 0 2 F dz2 2.565 2 -3 0 79 4784 342 1 Fe 11 3 2 1 2 F dxz 2.565 2 -3 0 80 4785 342 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -3 0 81 4786 342 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -3 0 82 4787 342 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -3 0 83 4788 342 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -3 0 84 4789 343 3 Te 1 5 0 0 1 F s 6.195 3 -3 0 1 4790 343 3 Te 2 5 0 0 2 F s 4.205 3 -3 0 2 4791 343 3 Te 3 5 1 -1 1 F py 8.156 3 -3 0 3 4792 343 3 Te 4 5 1 0 1 F pz 8.156 3 -3 0 4 4793 343 3 Te 5 5 1 1 1 F px 8.156 3 -3 0 5 4794 343 3 Te 6 5 1 -1 2 F py 5.009 3 -3 0 6 4795 343 3 Te 7 5 1 0 2 F pz 5.009 3 -3 0 7 4796 343 3 Te 8 5 1 1 2 F px 5.009 3 -3 0 8 4797 343 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -3 0 9 4798 343 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -3 0 10 4799 343 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -3 0 11 4800 343 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -3 0 12 4801 343 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -3 0 13 4802 344 3 Te 1 5 0 0 1 F s 6.195 3 -3 0 14 4803 344 3 Te 2 5 0 0 2 F s 4.205 3 -3 0 15 4804 344 3 Te 3 5 1 -1 1 F py 8.156 3 -3 0 16 4805 344 3 Te 4 5 1 0 1 F pz 8.156 3 -3 0 17 4806 344 3 Te 5 5 1 1 1 F px 8.156 3 -3 0 18 4807 344 3 Te 6 5 1 -1 2 F py 5.009 3 -3 0 19 4808 344 3 Te 7 5 1 0 2 F pz 5.009 3 -3 0 20 4809 344 3 Te 8 5 1 1 2 F px 5.009 3 -3 0 21 4810 344 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -3 0 22 4811 344 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -3 0 23 4812 344 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -3 0 24 4813 344 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -3 0 25 4814 344 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -3 0 26 4815 345 2 Ge 1 4 0 0 1 F s 6.581 3 -3 0 27 4816 345 2 Ge 2 4 0 0 2 F s 4.412 3 -3 0 28 4817 345 2 Ge 3 4 1 -1 1 F py 9.340 3 -3 0 29 4818 345 2 Ge 4 4 1 0 1 F pz 9.340 3 -3 0 30 4819 345 2 Ge 5 4 1 1 1 F px 9.340 3 -3 0 31 4820 345 2 Ge 6 4 1 -1 2 F py 5.665 3 -3 0 32 4821 345 2 Ge 7 4 1 0 2 F pz 5.665 3 -3 0 33 4822 345 2 Ge 8 4 1 1 2 F px 5.665 3 -3 0 34 4823 345 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 -3 0 35 4824 345 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 -3 0 36 4825 345 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 -3 0 37 4826 345 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 -3 0 38 4827 345 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 -3 0 39 4828 346 1 Fe 1 4 0 0 1 F s 9.649 3 -3 0 40 4829 346 1 Fe 2 4 0 0 2 F s 6.885 3 -3 0 41 4830 346 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -3 0 42 4831 346 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -3 0 43 4832 346 1 Fe 5 3 2 0 1 F dz2 6.632 3 -3 0 44 4833 346 1 Fe 6 3 2 1 1 F dxz 6.632 3 -3 0 45 4834 346 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -3 0 46 4835 346 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -3 0 47 4836 346 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -3 0 48 4837 346 1 Fe 10 3 2 0 2 F dz2 2.565 3 -3 0 49 4838 346 1 Fe 11 3 2 1 2 F dxz 2.565 3 -3 0 50 4839 346 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -3 0 51 4840 346 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -3 0 52 4841 346 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -3 0 53 4842 346 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -3 0 54 4843 347 1 Fe 1 4 0 0 1 F s 9.649 3 -3 0 55 4844 347 1 Fe 2 4 0 0 2 F s 6.885 3 -3 0 56 4845 347 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -3 0 57 4846 347 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -3 0 58 4847 347 1 Fe 5 3 2 0 1 F dz2 6.632 3 -3 0 59 4848 347 1 Fe 6 3 2 1 1 F dxz 6.632 3 -3 0 60 4849 347 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -3 0 61 4850 347 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -3 0 62 4851 347 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -3 0 63 4852 347 1 Fe 10 3 2 0 2 F dz2 2.565 3 -3 0 64 4853 347 1 Fe 11 3 2 1 2 F dxz 2.565 3 -3 0 65 4854 347 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -3 0 66 4855 347 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -3 0 67 4856 347 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -3 0 68 4857 347 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -3 0 69 4858 348 1 Fe 1 4 0 0 1 F s 9.649 3 -3 0 70 4859 348 1 Fe 2 4 0 0 2 F s 6.885 3 -3 0 71 4860 348 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -3 0 72 4861 348 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -3 0 73 4862 348 1 Fe 5 3 2 0 1 F dz2 6.632 3 -3 0 74 4863 348 1 Fe 6 3 2 1 1 F dxz 6.632 3 -3 0 75 4864 348 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -3 0 76 4865 348 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -3 0 77 4866 348 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -3 0 78 4867 348 1 Fe 10 3 2 0 2 F dz2 2.565 3 -3 0 79 4868 348 1 Fe 11 3 2 1 2 F dxz 2.565 3 -3 0 80 4869 348 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -3 0 81 4870 348 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -3 0 82 4871 348 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -3 0 83 4872 348 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -3 0 84 4873 349 3 Te 1 5 0 0 1 F s 6.195 4 -3 0 1 4874 349 3 Te 2 5 0 0 2 F s 4.205 4 -3 0 2 4875 349 3 Te 3 5 1 -1 1 F py 8.156 4 -3 0 3 4876 349 3 Te 4 5 1 0 1 F pz 8.156 4 -3 0 4 4877 349 3 Te 5 5 1 1 1 F px 8.156 4 -3 0 5 4878 349 3 Te 6 5 1 -1 2 F py 5.009 4 -3 0 6 4879 349 3 Te 7 5 1 0 2 F pz 5.009 4 -3 0 7 4880 349 3 Te 8 5 1 1 2 F px 5.009 4 -3 0 8 4881 349 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -3 0 9 4882 349 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -3 0 10 4883 349 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -3 0 11 4884 349 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -3 0 12 4885 349 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -3 0 13 4886 350 3 Te 1 5 0 0 1 F s 6.195 4 -3 0 14 4887 350 3 Te 2 5 0 0 2 F s 4.205 4 -3 0 15 4888 350 3 Te 3 5 1 -1 1 F py 8.156 4 -3 0 16 4889 350 3 Te 4 5 1 0 1 F pz 8.156 4 -3 0 17 4890 350 3 Te 5 5 1 1 1 F px 8.156 4 -3 0 18 4891 350 3 Te 6 5 1 -1 2 F py 5.009 4 -3 0 19 4892 350 3 Te 7 5 1 0 2 F pz 5.009 4 -3 0 20 4893 350 3 Te 8 5 1 1 2 F px 5.009 4 -3 0 21 4894 350 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -3 0 22 4895 350 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -3 0 23 4896 350 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -3 0 24 4897 350 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -3 0 25 4898 350 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -3 0 26 4899 351 2 Ge 1 4 0 0 1 F s 6.581 4 -3 0 27 4900 351 2 Ge 2 4 0 0 2 F s 4.412 4 -3 0 28 4901 351 2 Ge 3 4 1 -1 1 F py 9.340 4 -3 0 29 4902 351 2 Ge 4 4 1 0 1 F pz 9.340 4 -3 0 30 4903 351 2 Ge 5 4 1 1 1 F px 9.340 4 -3 0 31 4904 351 2 Ge 6 4 1 -1 2 F py 5.665 4 -3 0 32 4905 351 2 Ge 7 4 1 0 2 F pz 5.665 4 -3 0 33 4906 351 2 Ge 8 4 1 1 2 F px 5.665 4 -3 0 34 4907 351 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 -3 0 35 4908 351 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 -3 0 36 4909 351 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 -3 0 37 4910 351 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 -3 0 38 4911 351 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 -3 0 39 4912 352 1 Fe 1 4 0 0 1 F s 9.649 4 -3 0 40 4913 352 1 Fe 2 4 0 0 2 F s 6.885 4 -3 0 41 4914 352 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -3 0 42 4915 352 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -3 0 43 4916 352 1 Fe 5 3 2 0 1 F dz2 6.632 4 -3 0 44 4917 352 1 Fe 6 3 2 1 1 F dxz 6.632 4 -3 0 45 4918 352 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -3 0 46 4919 352 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -3 0 47 4920 352 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -3 0 48 4921 352 1 Fe 10 3 2 0 2 F dz2 2.565 4 -3 0 49 4922 352 1 Fe 11 3 2 1 2 F dxz 2.565 4 -3 0 50 4923 352 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -3 0 51 4924 352 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -3 0 52 4925 352 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -3 0 53 4926 352 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -3 0 54 4927 353 1 Fe 1 4 0 0 1 F s 9.649 4 -3 0 55 4928 353 1 Fe 2 4 0 0 2 F s 6.885 4 -3 0 56 4929 353 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -3 0 57 4930 353 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -3 0 58 4931 353 1 Fe 5 3 2 0 1 F dz2 6.632 4 -3 0 59 4932 353 1 Fe 6 3 2 1 1 F dxz 6.632 4 -3 0 60 4933 353 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -3 0 61 4934 353 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -3 0 62 4935 353 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -3 0 63 4936 353 1 Fe 10 3 2 0 2 F dz2 2.565 4 -3 0 64 4937 353 1 Fe 11 3 2 1 2 F dxz 2.565 4 -3 0 65 4938 353 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -3 0 66 4939 353 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -3 0 67 4940 353 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -3 0 68 4941 353 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -3 0 69 4942 354 1 Fe 1 4 0 0 1 F s 9.649 4 -3 0 70 4943 354 1 Fe 2 4 0 0 2 F s 6.885 4 -3 0 71 4944 354 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -3 0 72 4945 354 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -3 0 73 4946 354 1 Fe 5 3 2 0 1 F dz2 6.632 4 -3 0 74 4947 354 1 Fe 6 3 2 1 1 F dxz 6.632 4 -3 0 75 4948 354 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -3 0 76 4949 354 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -3 0 77 4950 354 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -3 0 78 4951 354 1 Fe 10 3 2 0 2 F dz2 2.565 4 -3 0 79 4952 354 1 Fe 11 3 2 1 2 F dxz 2.565 4 -3 0 80 4953 354 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -3 0 81 4954 354 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -3 0 82 4955 354 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -3 0 83 4956 354 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -3 0 84 4957 355 3 Te 1 5 0 0 1 F s 6.195 -4 -3 0 1 4958 355 3 Te 2 5 0 0 2 F s 4.205 -4 -3 0 2 4959 355 3 Te 3 5 1 -1 1 F py 8.156 -4 -3 0 3 4960 355 3 Te 4 5 1 0 1 F pz 8.156 -4 -3 0 4 4961 355 3 Te 5 5 1 1 1 F px 8.156 -4 -3 0 5 4962 355 3 Te 6 5 1 -1 2 F py 5.009 -4 -3 0 6 4963 355 3 Te 7 5 1 0 2 F pz 5.009 -4 -3 0 7 4964 355 3 Te 8 5 1 1 2 F px 5.009 -4 -3 0 8 4965 355 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -3 0 9 4966 355 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -3 0 10 4967 355 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -3 0 11 4968 355 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -3 0 12 4969 355 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -3 0 13 4970 356 3 Te 1 5 0 0 1 F s 6.195 -4 -3 0 14 4971 356 3 Te 2 5 0 0 2 F s 4.205 -4 -3 0 15 4972 356 3 Te 3 5 1 -1 1 F py 8.156 -4 -3 0 16 4973 356 3 Te 4 5 1 0 1 F pz 8.156 -4 -3 0 17 4974 356 3 Te 5 5 1 1 1 F px 8.156 -4 -3 0 18 4975 356 3 Te 6 5 1 -1 2 F py 5.009 -4 -3 0 19 4976 356 3 Te 7 5 1 0 2 F pz 5.009 -4 -3 0 20 4977 356 3 Te 8 5 1 1 2 F px 5.009 -4 -3 0 21 4978 356 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -3 0 22 4979 356 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -3 0 23 4980 356 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -3 0 24 4981 356 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -3 0 25 4982 356 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -3 0 26 4983 357 2 Ge 1 4 0 0 1 F s 6.581 -4 -3 0 27 4984 357 2 Ge 2 4 0 0 2 F s 4.412 -4 -3 0 28 4985 357 2 Ge 3 4 1 -1 1 F py 9.340 -4 -3 0 29 4986 357 2 Ge 4 4 1 0 1 F pz 9.340 -4 -3 0 30 4987 357 2 Ge 5 4 1 1 1 F px 9.340 -4 -3 0 31 4988 357 2 Ge 6 4 1 -1 2 F py 5.665 -4 -3 0 32 4989 357 2 Ge 7 4 1 0 2 F pz 5.665 -4 -3 0 33 4990 357 2 Ge 8 4 1 1 2 F px 5.665 -4 -3 0 34 4991 357 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 -3 0 35 4992 357 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 -3 0 36 4993 357 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 -3 0 37 4994 357 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 -3 0 38 4995 357 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 -3 0 39 4996 358 1 Fe 1 4 0 0 1 F s 9.649 -4 -3 0 40 4997 358 1 Fe 2 4 0 0 2 F s 6.885 -4 -3 0 41 4998 358 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -3 0 42 4999 358 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -3 0 43 5000 358 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -3 0 44 5001 358 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -3 0 45 5002 358 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -3 0 46 5003 358 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -3 0 47 5004 358 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -3 0 48 5005 358 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -3 0 49 5006 358 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -3 0 50 5007 358 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -3 0 51 5008 358 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -3 0 52 5009 358 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -3 0 53 5010 358 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -3 0 54 5011 359 1 Fe 1 4 0 0 1 F s 9.649 -4 -3 0 55 5012 359 1 Fe 2 4 0 0 2 F s 6.885 -4 -3 0 56 5013 359 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -3 0 57 5014 359 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -3 0 58 5015 359 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -3 0 59 5016 359 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -3 0 60 5017 359 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -3 0 61 5018 359 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -3 0 62 5019 359 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -3 0 63 5020 359 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -3 0 64 5021 359 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -3 0 65 5022 359 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -3 0 66 5023 359 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -3 0 67 5024 359 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -3 0 68 5025 359 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -3 0 69 5026 360 1 Fe 1 4 0 0 1 F s 9.649 -4 -3 0 70 5027 360 1 Fe 2 4 0 0 2 F s 6.885 -4 -3 0 71 5028 360 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -3 0 72 5029 360 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -3 0 73 5030 360 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -3 0 74 5031 360 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -3 0 75 5032 360 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -3 0 76 5033 360 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -3 0 77 5034 360 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -3 0 78 5035 360 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -3 0 79 5036 360 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -3 0 80 5037 360 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -3 0 81 5038 360 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -3 0 82 5039 360 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -3 0 83 5040 360 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -3 0 84 5041 361 3 Te 1 5 0 0 1 F s 6.195 -3 -3 0 1 5042 361 3 Te 2 5 0 0 2 F s 4.205 -3 -3 0 2 5043 361 3 Te 3 5 1 -1 1 F py 8.156 -3 -3 0 3 5044 361 3 Te 4 5 1 0 1 F pz 8.156 -3 -3 0 4 5045 361 3 Te 5 5 1 1 1 F px 8.156 -3 -3 0 5 5046 361 3 Te 6 5 1 -1 2 F py 5.009 -3 -3 0 6 5047 361 3 Te 7 5 1 0 2 F pz 5.009 -3 -3 0 7 5048 361 3 Te 8 5 1 1 2 F px 5.009 -3 -3 0 8 5049 361 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -3 0 9 5050 361 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -3 0 10 5051 361 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -3 0 11 5052 361 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -3 0 12 5053 361 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -3 0 13 5054 362 3 Te 1 5 0 0 1 F s 6.195 -3 -3 0 14 5055 362 3 Te 2 5 0 0 2 F s 4.205 -3 -3 0 15 5056 362 3 Te 3 5 1 -1 1 F py 8.156 -3 -3 0 16 5057 362 3 Te 4 5 1 0 1 F pz 8.156 -3 -3 0 17 5058 362 3 Te 5 5 1 1 1 F px 8.156 -3 -3 0 18 5059 362 3 Te 6 5 1 -1 2 F py 5.009 -3 -3 0 19 5060 362 3 Te 7 5 1 0 2 F pz 5.009 -3 -3 0 20 5061 362 3 Te 8 5 1 1 2 F px 5.009 -3 -3 0 21 5062 362 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -3 0 22 5063 362 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -3 0 23 5064 362 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -3 0 24 5065 362 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -3 0 25 5066 362 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -3 0 26 5067 363 2 Ge 1 4 0 0 1 F s 6.581 -3 -3 0 27 5068 363 2 Ge 2 4 0 0 2 F s 4.412 -3 -3 0 28 5069 363 2 Ge 3 4 1 -1 1 F py 9.340 -3 -3 0 29 5070 363 2 Ge 4 4 1 0 1 F pz 9.340 -3 -3 0 30 5071 363 2 Ge 5 4 1 1 1 F px 9.340 -3 -3 0 31 5072 363 2 Ge 6 4 1 -1 2 F py 5.665 -3 -3 0 32 5073 363 2 Ge 7 4 1 0 2 F pz 5.665 -3 -3 0 33 5074 363 2 Ge 8 4 1 1 2 F px 5.665 -3 -3 0 34 5075 363 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 -3 0 35 5076 363 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 -3 0 36 5077 363 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 -3 0 37 5078 363 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 -3 0 38 5079 363 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 -3 0 39 5080 364 1 Fe 1 4 0 0 1 F s 9.649 -3 -3 0 40 5081 364 1 Fe 2 4 0 0 2 F s 6.885 -3 -3 0 41 5082 364 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -3 0 42 5083 364 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -3 0 43 5084 364 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -3 0 44 5085 364 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -3 0 45 5086 364 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -3 0 46 5087 364 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -3 0 47 5088 364 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -3 0 48 5089 364 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -3 0 49 5090 364 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -3 0 50 5091 364 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -3 0 51 5092 364 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -3 0 52 5093 364 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -3 0 53 5094 364 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -3 0 54 5095 365 1 Fe 1 4 0 0 1 F s 9.649 -3 -3 0 55 5096 365 1 Fe 2 4 0 0 2 F s 6.885 -3 -3 0 56 5097 365 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -3 0 57 5098 365 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -3 0 58 5099 365 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -3 0 59 5100 365 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -3 0 60 5101 365 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -3 0 61 5102 365 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -3 0 62 5103 365 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -3 0 63 5104 365 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -3 0 64 5105 365 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -3 0 65 5106 365 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -3 0 66 5107 365 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -3 0 67 5108 365 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -3 0 68 5109 365 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -3 0 69 5110 366 1 Fe 1 4 0 0 1 F s 9.649 -3 -3 0 70 5111 366 1 Fe 2 4 0 0 2 F s 6.885 -3 -3 0 71 5112 366 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -3 0 72 5113 366 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -3 0 73 5114 366 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -3 0 74 5115 366 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -3 0 75 5116 366 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -3 0 76 5117 366 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -3 0 77 5118 366 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -3 0 78 5119 366 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -3 0 79 5120 366 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -3 0 80 5121 366 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -3 0 81 5122 366 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -3 0 82 5123 366 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -3 0 83 5124 366 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -3 0 84 5125 367 3 Te 1 5 0 0 1 F s 6.195 -2 -3 0 1 5126 367 3 Te 2 5 0 0 2 F s 4.205 -2 -3 0 2 5127 367 3 Te 3 5 1 -1 1 F py 8.156 -2 -3 0 3 5128 367 3 Te 4 5 1 0 1 F pz 8.156 -2 -3 0 4 5129 367 3 Te 5 5 1 1 1 F px 8.156 -2 -3 0 5 5130 367 3 Te 6 5 1 -1 2 F py 5.009 -2 -3 0 6 5131 367 3 Te 7 5 1 0 2 F pz 5.009 -2 -3 0 7 5132 367 3 Te 8 5 1 1 2 F px 5.009 -2 -3 0 8 5133 367 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -3 0 9 5134 367 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -3 0 10 5135 367 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -3 0 11 5136 367 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -3 0 12 5137 367 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -3 0 13 5138 368 3 Te 1 5 0 0 1 F s 6.195 -2 -3 0 14 5139 368 3 Te 2 5 0 0 2 F s 4.205 -2 -3 0 15 5140 368 3 Te 3 5 1 -1 1 F py 8.156 -2 -3 0 16 5141 368 3 Te 4 5 1 0 1 F pz 8.156 -2 -3 0 17 5142 368 3 Te 5 5 1 1 1 F px 8.156 -2 -3 0 18 5143 368 3 Te 6 5 1 -1 2 F py 5.009 -2 -3 0 19 5144 368 3 Te 7 5 1 0 2 F pz 5.009 -2 -3 0 20 5145 368 3 Te 8 5 1 1 2 F px 5.009 -2 -3 0 21 5146 368 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -3 0 22 5147 368 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -3 0 23 5148 368 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -3 0 24 5149 368 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -3 0 25 5150 368 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -3 0 26 5151 369 2 Ge 1 4 0 0 1 F s 6.581 -2 -3 0 27 5152 369 2 Ge 2 4 0 0 2 F s 4.412 -2 -3 0 28 5153 369 2 Ge 3 4 1 -1 1 F py 9.340 -2 -3 0 29 5154 369 2 Ge 4 4 1 0 1 F pz 9.340 -2 -3 0 30 5155 369 2 Ge 5 4 1 1 1 F px 9.340 -2 -3 0 31 5156 369 2 Ge 6 4 1 -1 2 F py 5.665 -2 -3 0 32 5157 369 2 Ge 7 4 1 0 2 F pz 5.665 -2 -3 0 33 5158 369 2 Ge 8 4 1 1 2 F px 5.665 -2 -3 0 34 5159 369 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 -3 0 35 5160 369 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 -3 0 36 5161 369 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 -3 0 37 5162 369 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 -3 0 38 5163 369 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 -3 0 39 5164 370 1 Fe 1 4 0 0 1 F s 9.649 -2 -3 0 40 5165 370 1 Fe 2 4 0 0 2 F s 6.885 -2 -3 0 41 5166 370 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -3 0 42 5167 370 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -3 0 43 5168 370 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -3 0 44 5169 370 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -3 0 45 5170 370 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -3 0 46 5171 370 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -3 0 47 5172 370 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -3 0 48 5173 370 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -3 0 49 5174 370 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -3 0 50 5175 370 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -3 0 51 5176 370 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -3 0 52 5177 370 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -3 0 53 5178 370 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -3 0 54 5179 371 1 Fe 1 4 0 0 1 F s 9.649 -2 -3 0 55 5180 371 1 Fe 2 4 0 0 2 F s 6.885 -2 -3 0 56 5181 371 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -3 0 57 5182 371 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -3 0 58 5183 371 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -3 0 59 5184 371 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -3 0 60 5185 371 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -3 0 61 5186 371 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -3 0 62 5187 371 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -3 0 63 5188 371 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -3 0 64 5189 371 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -3 0 65 5190 371 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -3 0 66 5191 371 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -3 0 67 5192 371 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -3 0 68 5193 371 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -3 0 69 5194 372 1 Fe 1 4 0 0 1 F s 9.649 -2 -3 0 70 5195 372 1 Fe 2 4 0 0 2 F s 6.885 -2 -3 0 71 5196 372 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -3 0 72 5197 372 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -3 0 73 5198 372 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -3 0 74 5199 372 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -3 0 75 5200 372 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -3 0 76 5201 372 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -3 0 77 5202 372 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -3 0 78 5203 372 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -3 0 79 5204 372 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -3 0 80 5205 372 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -3 0 81 5206 372 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -3 0 82 5207 372 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -3 0 83 5208 372 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -3 0 84 5209 373 3 Te 1 5 0 0 1 F s 6.195 -1 -3 0 1 5210 373 3 Te 2 5 0 0 2 F s 4.205 -1 -3 0 2 5211 373 3 Te 3 5 1 -1 1 F py 8.156 -1 -3 0 3 5212 373 3 Te 4 5 1 0 1 F pz 8.156 -1 -3 0 4 5213 373 3 Te 5 5 1 1 1 F px 8.156 -1 -3 0 5 5214 373 3 Te 6 5 1 -1 2 F py 5.009 -1 -3 0 6 5215 373 3 Te 7 5 1 0 2 F pz 5.009 -1 -3 0 7 5216 373 3 Te 8 5 1 1 2 F px 5.009 -1 -3 0 8 5217 373 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -3 0 9 5218 373 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -3 0 10 5219 373 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -3 0 11 5220 373 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -3 0 12 5221 373 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -3 0 13 5222 374 3 Te 1 5 0 0 1 F s 6.195 -1 -3 0 14 5223 374 3 Te 2 5 0 0 2 F s 4.205 -1 -3 0 15 5224 374 3 Te 3 5 1 -1 1 F py 8.156 -1 -3 0 16 5225 374 3 Te 4 5 1 0 1 F pz 8.156 -1 -3 0 17 5226 374 3 Te 5 5 1 1 1 F px 8.156 -1 -3 0 18 5227 374 3 Te 6 5 1 -1 2 F py 5.009 -1 -3 0 19 5228 374 3 Te 7 5 1 0 2 F pz 5.009 -1 -3 0 20 5229 374 3 Te 8 5 1 1 2 F px 5.009 -1 -3 0 21 5230 374 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -3 0 22 5231 374 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -3 0 23 5232 374 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -3 0 24 5233 374 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -3 0 25 5234 374 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -3 0 26 5235 375 2 Ge 1 4 0 0 1 F s 6.581 -1 -3 0 27 5236 375 2 Ge 2 4 0 0 2 F s 4.412 -1 -3 0 28 5237 375 2 Ge 3 4 1 -1 1 F py 9.340 -1 -3 0 29 5238 375 2 Ge 4 4 1 0 1 F pz 9.340 -1 -3 0 30 5239 375 2 Ge 5 4 1 1 1 F px 9.340 -1 -3 0 31 5240 375 2 Ge 6 4 1 -1 2 F py 5.665 -1 -3 0 32 5241 375 2 Ge 7 4 1 0 2 F pz 5.665 -1 -3 0 33 5242 375 2 Ge 8 4 1 1 2 F px 5.665 -1 -3 0 34 5243 375 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 -3 0 35 5244 375 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 -3 0 36 5245 375 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 -3 0 37 5246 375 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 -3 0 38 5247 375 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 -3 0 39 5248 376 1 Fe 1 4 0 0 1 F s 9.649 -1 -3 0 40 5249 376 1 Fe 2 4 0 0 2 F s 6.885 -1 -3 0 41 5250 376 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -3 0 42 5251 376 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -3 0 43 5252 376 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -3 0 44 5253 376 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -3 0 45 5254 376 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -3 0 46 5255 376 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -3 0 47 5256 376 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -3 0 48 5257 376 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -3 0 49 5258 376 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -3 0 50 5259 376 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -3 0 51 5260 376 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -3 0 52 5261 376 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -3 0 53 5262 376 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -3 0 54 5263 377 1 Fe 1 4 0 0 1 F s 9.649 -1 -3 0 55 5264 377 1 Fe 2 4 0 0 2 F s 6.885 -1 -3 0 56 5265 377 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -3 0 57 5266 377 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -3 0 58 5267 377 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -3 0 59 5268 377 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -3 0 60 5269 377 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -3 0 61 5270 377 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -3 0 62 5271 377 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -3 0 63 5272 377 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -3 0 64 5273 377 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -3 0 65 5274 377 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -3 0 66 5275 377 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -3 0 67 5276 377 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -3 0 68 5277 377 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -3 0 69 5278 378 1 Fe 1 4 0 0 1 F s 9.649 -1 -3 0 70 5279 378 1 Fe 2 4 0 0 2 F s 6.885 -1 -3 0 71 5280 378 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -3 0 72 5281 378 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -3 0 73 5282 378 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -3 0 74 5283 378 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -3 0 75 5284 378 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -3 0 76 5285 378 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -3 0 77 5286 378 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -3 0 78 5287 378 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -3 0 79 5288 378 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -3 0 80 5289 378 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -3 0 81 5290 378 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -3 0 82 5291 378 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -3 0 83 5292 378 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -3 0 84 5293 379 3 Te 1 5 0 0 1 F s 6.195 0 -2 0 1 5294 379 3 Te 2 5 0 0 2 F s 4.205 0 -2 0 2 5295 379 3 Te 3 5 1 -1 1 F py 8.156 0 -2 0 3 5296 379 3 Te 4 5 1 0 1 F pz 8.156 0 -2 0 4 5297 379 3 Te 5 5 1 1 1 F px 8.156 0 -2 0 5 5298 379 3 Te 6 5 1 -1 2 F py 5.009 0 -2 0 6 5299 379 3 Te 7 5 1 0 2 F pz 5.009 0 -2 0 7 5300 379 3 Te 8 5 1 1 2 F px 5.009 0 -2 0 8 5301 379 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -2 0 9 5302 379 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -2 0 10 5303 379 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -2 0 11 5304 379 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -2 0 12 5305 379 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -2 0 13 5306 380 3 Te 1 5 0 0 1 F s 6.195 0 -2 0 14 5307 380 3 Te 2 5 0 0 2 F s 4.205 0 -2 0 15 5308 380 3 Te 3 5 1 -1 1 F py 8.156 0 -2 0 16 5309 380 3 Te 4 5 1 0 1 F pz 8.156 0 -2 0 17 5310 380 3 Te 5 5 1 1 1 F px 8.156 0 -2 0 18 5311 380 3 Te 6 5 1 -1 2 F py 5.009 0 -2 0 19 5312 380 3 Te 7 5 1 0 2 F pz 5.009 0 -2 0 20 5313 380 3 Te 8 5 1 1 2 F px 5.009 0 -2 0 21 5314 380 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -2 0 22 5315 380 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -2 0 23 5316 380 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -2 0 24 5317 380 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -2 0 25 5318 380 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -2 0 26 5319 381 2 Ge 1 4 0 0 1 F s 6.581 0 -2 0 27 5320 381 2 Ge 2 4 0 0 2 F s 4.412 0 -2 0 28 5321 381 2 Ge 3 4 1 -1 1 F py 9.340 0 -2 0 29 5322 381 2 Ge 4 4 1 0 1 F pz 9.340 0 -2 0 30 5323 381 2 Ge 5 4 1 1 1 F px 9.340 0 -2 0 31 5324 381 2 Ge 6 4 1 -1 2 F py 5.665 0 -2 0 32 5325 381 2 Ge 7 4 1 0 2 F pz 5.665 0 -2 0 33 5326 381 2 Ge 8 4 1 1 2 F px 5.665 0 -2 0 34 5327 381 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 -2 0 35 5328 381 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 -2 0 36 5329 381 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 -2 0 37 5330 381 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 -2 0 38 5331 381 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 -2 0 39 5332 382 1 Fe 1 4 0 0 1 F s 9.649 0 -2 0 40 5333 382 1 Fe 2 4 0 0 2 F s 6.885 0 -2 0 41 5334 382 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -2 0 42 5335 382 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -2 0 43 5336 382 1 Fe 5 3 2 0 1 F dz2 6.632 0 -2 0 44 5337 382 1 Fe 6 3 2 1 1 F dxz 6.632 0 -2 0 45 5338 382 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -2 0 46 5339 382 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -2 0 47 5340 382 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -2 0 48 5341 382 1 Fe 10 3 2 0 2 F dz2 2.565 0 -2 0 49 5342 382 1 Fe 11 3 2 1 2 F dxz 2.565 0 -2 0 50 5343 382 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -2 0 51 5344 382 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -2 0 52 5345 382 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -2 0 53 5346 382 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -2 0 54 5347 383 1 Fe 1 4 0 0 1 F s 9.649 0 -2 0 55 5348 383 1 Fe 2 4 0 0 2 F s 6.885 0 -2 0 56 5349 383 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -2 0 57 5350 383 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -2 0 58 5351 383 1 Fe 5 3 2 0 1 F dz2 6.632 0 -2 0 59 5352 383 1 Fe 6 3 2 1 1 F dxz 6.632 0 -2 0 60 5353 383 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -2 0 61 5354 383 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -2 0 62 5355 383 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -2 0 63 5356 383 1 Fe 10 3 2 0 2 F dz2 2.565 0 -2 0 64 5357 383 1 Fe 11 3 2 1 2 F dxz 2.565 0 -2 0 65 5358 383 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -2 0 66 5359 383 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -2 0 67 5360 383 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -2 0 68 5361 383 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -2 0 69 5362 384 1 Fe 1 4 0 0 1 F s 9.649 0 -2 0 70 5363 384 1 Fe 2 4 0 0 2 F s 6.885 0 -2 0 71 5364 384 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -2 0 72 5365 384 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -2 0 73 5366 384 1 Fe 5 3 2 0 1 F dz2 6.632 0 -2 0 74 5367 384 1 Fe 6 3 2 1 1 F dxz 6.632 0 -2 0 75 5368 384 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -2 0 76 5369 384 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -2 0 77 5370 384 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -2 0 78 5371 384 1 Fe 10 3 2 0 2 F dz2 2.565 0 -2 0 79 5372 384 1 Fe 11 3 2 1 2 F dxz 2.565 0 -2 0 80 5373 384 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -2 0 81 5374 384 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -2 0 82 5375 384 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -2 0 83 5376 384 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -2 0 84 5377 385 3 Te 1 5 0 0 1 F s 6.195 1 -2 0 1 5378 385 3 Te 2 5 0 0 2 F s 4.205 1 -2 0 2 5379 385 3 Te 3 5 1 -1 1 F py 8.156 1 -2 0 3 5380 385 3 Te 4 5 1 0 1 F pz 8.156 1 -2 0 4 5381 385 3 Te 5 5 1 1 1 F px 8.156 1 -2 0 5 5382 385 3 Te 6 5 1 -1 2 F py 5.009 1 -2 0 6 5383 385 3 Te 7 5 1 0 2 F pz 5.009 1 -2 0 7 5384 385 3 Te 8 5 1 1 2 F px 5.009 1 -2 0 8 5385 385 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -2 0 9 5386 385 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -2 0 10 5387 385 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -2 0 11 5388 385 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -2 0 12 5389 385 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -2 0 13 5390 386 3 Te 1 5 0 0 1 F s 6.195 1 -2 0 14 5391 386 3 Te 2 5 0 0 2 F s 4.205 1 -2 0 15 5392 386 3 Te 3 5 1 -1 1 F py 8.156 1 -2 0 16 5393 386 3 Te 4 5 1 0 1 F pz 8.156 1 -2 0 17 5394 386 3 Te 5 5 1 1 1 F px 8.156 1 -2 0 18 5395 386 3 Te 6 5 1 -1 2 F py 5.009 1 -2 0 19 5396 386 3 Te 7 5 1 0 2 F pz 5.009 1 -2 0 20 5397 386 3 Te 8 5 1 1 2 F px 5.009 1 -2 0 21 5398 386 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -2 0 22 5399 386 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -2 0 23 5400 386 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -2 0 24 5401 386 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -2 0 25 5402 386 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -2 0 26 5403 387 2 Ge 1 4 0 0 1 F s 6.581 1 -2 0 27 5404 387 2 Ge 2 4 0 0 2 F s 4.412 1 -2 0 28 5405 387 2 Ge 3 4 1 -1 1 F py 9.340 1 -2 0 29 5406 387 2 Ge 4 4 1 0 1 F pz 9.340 1 -2 0 30 5407 387 2 Ge 5 4 1 1 1 F px 9.340 1 -2 0 31 5408 387 2 Ge 6 4 1 -1 2 F py 5.665 1 -2 0 32 5409 387 2 Ge 7 4 1 0 2 F pz 5.665 1 -2 0 33 5410 387 2 Ge 8 4 1 1 2 F px 5.665 1 -2 0 34 5411 387 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 -2 0 35 5412 387 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 -2 0 36 5413 387 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 -2 0 37 5414 387 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 -2 0 38 5415 387 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 -2 0 39 5416 388 1 Fe 1 4 0 0 1 F s 9.649 1 -2 0 40 5417 388 1 Fe 2 4 0 0 2 F s 6.885 1 -2 0 41 5418 388 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -2 0 42 5419 388 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -2 0 43 5420 388 1 Fe 5 3 2 0 1 F dz2 6.632 1 -2 0 44 5421 388 1 Fe 6 3 2 1 1 F dxz 6.632 1 -2 0 45 5422 388 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -2 0 46 5423 388 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -2 0 47 5424 388 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -2 0 48 5425 388 1 Fe 10 3 2 0 2 F dz2 2.565 1 -2 0 49 5426 388 1 Fe 11 3 2 1 2 F dxz 2.565 1 -2 0 50 5427 388 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -2 0 51 5428 388 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -2 0 52 5429 388 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -2 0 53 5430 388 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -2 0 54 5431 389 1 Fe 1 4 0 0 1 F s 9.649 1 -2 0 55 5432 389 1 Fe 2 4 0 0 2 F s 6.885 1 -2 0 56 5433 389 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -2 0 57 5434 389 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -2 0 58 5435 389 1 Fe 5 3 2 0 1 F dz2 6.632 1 -2 0 59 5436 389 1 Fe 6 3 2 1 1 F dxz 6.632 1 -2 0 60 5437 389 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -2 0 61 5438 389 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -2 0 62 5439 389 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -2 0 63 5440 389 1 Fe 10 3 2 0 2 F dz2 2.565 1 -2 0 64 5441 389 1 Fe 11 3 2 1 2 F dxz 2.565 1 -2 0 65 5442 389 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -2 0 66 5443 389 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -2 0 67 5444 389 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -2 0 68 5445 389 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -2 0 69 5446 390 1 Fe 1 4 0 0 1 F s 9.649 1 -2 0 70 5447 390 1 Fe 2 4 0 0 2 F s 6.885 1 -2 0 71 5448 390 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -2 0 72 5449 390 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -2 0 73 5450 390 1 Fe 5 3 2 0 1 F dz2 6.632 1 -2 0 74 5451 390 1 Fe 6 3 2 1 1 F dxz 6.632 1 -2 0 75 5452 390 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -2 0 76 5453 390 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -2 0 77 5454 390 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -2 0 78 5455 390 1 Fe 10 3 2 0 2 F dz2 2.565 1 -2 0 79 5456 390 1 Fe 11 3 2 1 2 F dxz 2.565 1 -2 0 80 5457 390 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -2 0 81 5458 390 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -2 0 82 5459 390 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -2 0 83 5460 390 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -2 0 84 5461 391 3 Te 1 5 0 0 1 F s 6.195 2 -2 0 1 5462 391 3 Te 2 5 0 0 2 F s 4.205 2 -2 0 2 5463 391 3 Te 3 5 1 -1 1 F py 8.156 2 -2 0 3 5464 391 3 Te 4 5 1 0 1 F pz 8.156 2 -2 0 4 5465 391 3 Te 5 5 1 1 1 F px 8.156 2 -2 0 5 5466 391 3 Te 6 5 1 -1 2 F py 5.009 2 -2 0 6 5467 391 3 Te 7 5 1 0 2 F pz 5.009 2 -2 0 7 5468 391 3 Te 8 5 1 1 2 F px 5.009 2 -2 0 8 5469 391 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -2 0 9 5470 391 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -2 0 10 5471 391 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -2 0 11 5472 391 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -2 0 12 5473 391 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -2 0 13 5474 392 3 Te 1 5 0 0 1 F s 6.195 2 -2 0 14 5475 392 3 Te 2 5 0 0 2 F s 4.205 2 -2 0 15 5476 392 3 Te 3 5 1 -1 1 F py 8.156 2 -2 0 16 5477 392 3 Te 4 5 1 0 1 F pz 8.156 2 -2 0 17 5478 392 3 Te 5 5 1 1 1 F px 8.156 2 -2 0 18 5479 392 3 Te 6 5 1 -1 2 F py 5.009 2 -2 0 19 5480 392 3 Te 7 5 1 0 2 F pz 5.009 2 -2 0 20 5481 392 3 Te 8 5 1 1 2 F px 5.009 2 -2 0 21 5482 392 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -2 0 22 5483 392 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -2 0 23 5484 392 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -2 0 24 5485 392 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -2 0 25 5486 392 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -2 0 26 5487 393 2 Ge 1 4 0 0 1 F s 6.581 2 -2 0 27 5488 393 2 Ge 2 4 0 0 2 F s 4.412 2 -2 0 28 5489 393 2 Ge 3 4 1 -1 1 F py 9.340 2 -2 0 29 5490 393 2 Ge 4 4 1 0 1 F pz 9.340 2 -2 0 30 5491 393 2 Ge 5 4 1 1 1 F px 9.340 2 -2 0 31 5492 393 2 Ge 6 4 1 -1 2 F py 5.665 2 -2 0 32 5493 393 2 Ge 7 4 1 0 2 F pz 5.665 2 -2 0 33 5494 393 2 Ge 8 4 1 1 2 F px 5.665 2 -2 0 34 5495 393 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 -2 0 35 5496 393 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 -2 0 36 5497 393 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 -2 0 37 5498 393 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 -2 0 38 5499 393 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 -2 0 39 5500 394 1 Fe 1 4 0 0 1 F s 9.649 2 -2 0 40 5501 394 1 Fe 2 4 0 0 2 F s 6.885 2 -2 0 41 5502 394 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -2 0 42 5503 394 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -2 0 43 5504 394 1 Fe 5 3 2 0 1 F dz2 6.632 2 -2 0 44 5505 394 1 Fe 6 3 2 1 1 F dxz 6.632 2 -2 0 45 5506 394 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -2 0 46 5507 394 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -2 0 47 5508 394 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -2 0 48 5509 394 1 Fe 10 3 2 0 2 F dz2 2.565 2 -2 0 49 5510 394 1 Fe 11 3 2 1 2 F dxz 2.565 2 -2 0 50 5511 394 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -2 0 51 5512 394 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -2 0 52 5513 394 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -2 0 53 5514 394 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -2 0 54 5515 395 1 Fe 1 4 0 0 1 F s 9.649 2 -2 0 55 5516 395 1 Fe 2 4 0 0 2 F s 6.885 2 -2 0 56 5517 395 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -2 0 57 5518 395 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -2 0 58 5519 395 1 Fe 5 3 2 0 1 F dz2 6.632 2 -2 0 59 5520 395 1 Fe 6 3 2 1 1 F dxz 6.632 2 -2 0 60 5521 395 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -2 0 61 5522 395 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -2 0 62 5523 395 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -2 0 63 5524 395 1 Fe 10 3 2 0 2 F dz2 2.565 2 -2 0 64 5525 395 1 Fe 11 3 2 1 2 F dxz 2.565 2 -2 0 65 5526 395 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -2 0 66 5527 395 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -2 0 67 5528 395 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -2 0 68 5529 395 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -2 0 69 5530 396 1 Fe 1 4 0 0 1 F s 9.649 2 -2 0 70 5531 396 1 Fe 2 4 0 0 2 F s 6.885 2 -2 0 71 5532 396 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -2 0 72 5533 396 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -2 0 73 5534 396 1 Fe 5 3 2 0 1 F dz2 6.632 2 -2 0 74 5535 396 1 Fe 6 3 2 1 1 F dxz 6.632 2 -2 0 75 5536 396 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -2 0 76 5537 396 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -2 0 77 5538 396 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -2 0 78 5539 396 1 Fe 10 3 2 0 2 F dz2 2.565 2 -2 0 79 5540 396 1 Fe 11 3 2 1 2 F dxz 2.565 2 -2 0 80 5541 396 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -2 0 81 5542 396 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -2 0 82 5543 396 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -2 0 83 5544 396 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -2 0 84 5545 397 3 Te 1 5 0 0 1 F s 6.195 3 -2 0 1 5546 397 3 Te 2 5 0 0 2 F s 4.205 3 -2 0 2 5547 397 3 Te 3 5 1 -1 1 F py 8.156 3 -2 0 3 5548 397 3 Te 4 5 1 0 1 F pz 8.156 3 -2 0 4 5549 397 3 Te 5 5 1 1 1 F px 8.156 3 -2 0 5 5550 397 3 Te 6 5 1 -1 2 F py 5.009 3 -2 0 6 5551 397 3 Te 7 5 1 0 2 F pz 5.009 3 -2 0 7 5552 397 3 Te 8 5 1 1 2 F px 5.009 3 -2 0 8 5553 397 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -2 0 9 5554 397 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -2 0 10 5555 397 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -2 0 11 5556 397 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -2 0 12 5557 397 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -2 0 13 5558 398 3 Te 1 5 0 0 1 F s 6.195 3 -2 0 14 5559 398 3 Te 2 5 0 0 2 F s 4.205 3 -2 0 15 5560 398 3 Te 3 5 1 -1 1 F py 8.156 3 -2 0 16 5561 398 3 Te 4 5 1 0 1 F pz 8.156 3 -2 0 17 5562 398 3 Te 5 5 1 1 1 F px 8.156 3 -2 0 18 5563 398 3 Te 6 5 1 -1 2 F py 5.009 3 -2 0 19 5564 398 3 Te 7 5 1 0 2 F pz 5.009 3 -2 0 20 5565 398 3 Te 8 5 1 1 2 F px 5.009 3 -2 0 21 5566 398 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -2 0 22 5567 398 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -2 0 23 5568 398 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -2 0 24 5569 398 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -2 0 25 5570 398 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -2 0 26 5571 399 2 Ge 1 4 0 0 1 F s 6.581 3 -2 0 27 5572 399 2 Ge 2 4 0 0 2 F s 4.412 3 -2 0 28 5573 399 2 Ge 3 4 1 -1 1 F py 9.340 3 -2 0 29 5574 399 2 Ge 4 4 1 0 1 F pz 9.340 3 -2 0 30 5575 399 2 Ge 5 4 1 1 1 F px 9.340 3 -2 0 31 5576 399 2 Ge 6 4 1 -1 2 F py 5.665 3 -2 0 32 5577 399 2 Ge 7 4 1 0 2 F pz 5.665 3 -2 0 33 5578 399 2 Ge 8 4 1 1 2 F px 5.665 3 -2 0 34 5579 399 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 -2 0 35 5580 399 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 -2 0 36 5581 399 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 -2 0 37 5582 399 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 -2 0 38 5583 399 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 -2 0 39 5584 400 1 Fe 1 4 0 0 1 F s 9.649 3 -2 0 40 5585 400 1 Fe 2 4 0 0 2 F s 6.885 3 -2 0 41 5586 400 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -2 0 42 5587 400 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -2 0 43 5588 400 1 Fe 5 3 2 0 1 F dz2 6.632 3 -2 0 44 5589 400 1 Fe 6 3 2 1 1 F dxz 6.632 3 -2 0 45 5590 400 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -2 0 46 5591 400 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -2 0 47 5592 400 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -2 0 48 5593 400 1 Fe 10 3 2 0 2 F dz2 2.565 3 -2 0 49 5594 400 1 Fe 11 3 2 1 2 F dxz 2.565 3 -2 0 50 5595 400 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -2 0 51 5596 400 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -2 0 52 5597 400 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -2 0 53 5598 400 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -2 0 54 5599 401 1 Fe 1 4 0 0 1 F s 9.649 3 -2 0 55 5600 401 1 Fe 2 4 0 0 2 F s 6.885 3 -2 0 56 5601 401 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -2 0 57 5602 401 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -2 0 58 5603 401 1 Fe 5 3 2 0 1 F dz2 6.632 3 -2 0 59 5604 401 1 Fe 6 3 2 1 1 F dxz 6.632 3 -2 0 60 5605 401 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -2 0 61 5606 401 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -2 0 62 5607 401 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -2 0 63 5608 401 1 Fe 10 3 2 0 2 F dz2 2.565 3 -2 0 64 5609 401 1 Fe 11 3 2 1 2 F dxz 2.565 3 -2 0 65 5610 401 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -2 0 66 5611 401 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -2 0 67 5612 401 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -2 0 68 5613 401 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -2 0 69 5614 402 1 Fe 1 4 0 0 1 F s 9.649 3 -2 0 70 5615 402 1 Fe 2 4 0 0 2 F s 6.885 3 -2 0 71 5616 402 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -2 0 72 5617 402 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -2 0 73 5618 402 1 Fe 5 3 2 0 1 F dz2 6.632 3 -2 0 74 5619 402 1 Fe 6 3 2 1 1 F dxz 6.632 3 -2 0 75 5620 402 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -2 0 76 5621 402 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -2 0 77 5622 402 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -2 0 78 5623 402 1 Fe 10 3 2 0 2 F dz2 2.565 3 -2 0 79 5624 402 1 Fe 11 3 2 1 2 F dxz 2.565 3 -2 0 80 5625 402 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -2 0 81 5626 402 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -2 0 82 5627 402 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -2 0 83 5628 402 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -2 0 84 5629 403 3 Te 1 5 0 0 1 F s 6.195 4 -2 0 1 5630 403 3 Te 2 5 0 0 2 F s 4.205 4 -2 0 2 5631 403 3 Te 3 5 1 -1 1 F py 8.156 4 -2 0 3 5632 403 3 Te 4 5 1 0 1 F pz 8.156 4 -2 0 4 5633 403 3 Te 5 5 1 1 1 F px 8.156 4 -2 0 5 5634 403 3 Te 6 5 1 -1 2 F py 5.009 4 -2 0 6 5635 403 3 Te 7 5 1 0 2 F pz 5.009 4 -2 0 7 5636 403 3 Te 8 5 1 1 2 F px 5.009 4 -2 0 8 5637 403 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -2 0 9 5638 403 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -2 0 10 5639 403 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -2 0 11 5640 403 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -2 0 12 5641 403 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -2 0 13 5642 404 3 Te 1 5 0 0 1 F s 6.195 4 -2 0 14 5643 404 3 Te 2 5 0 0 2 F s 4.205 4 -2 0 15 5644 404 3 Te 3 5 1 -1 1 F py 8.156 4 -2 0 16 5645 404 3 Te 4 5 1 0 1 F pz 8.156 4 -2 0 17 5646 404 3 Te 5 5 1 1 1 F px 8.156 4 -2 0 18 5647 404 3 Te 6 5 1 -1 2 F py 5.009 4 -2 0 19 5648 404 3 Te 7 5 1 0 2 F pz 5.009 4 -2 0 20 5649 404 3 Te 8 5 1 1 2 F px 5.009 4 -2 0 21 5650 404 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -2 0 22 5651 404 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -2 0 23 5652 404 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -2 0 24 5653 404 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -2 0 25 5654 404 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -2 0 26 5655 405 2 Ge 1 4 0 0 1 F s 6.581 4 -2 0 27 5656 405 2 Ge 2 4 0 0 2 F s 4.412 4 -2 0 28 5657 405 2 Ge 3 4 1 -1 1 F py 9.340 4 -2 0 29 5658 405 2 Ge 4 4 1 0 1 F pz 9.340 4 -2 0 30 5659 405 2 Ge 5 4 1 1 1 F px 9.340 4 -2 0 31 5660 405 2 Ge 6 4 1 -1 2 F py 5.665 4 -2 0 32 5661 405 2 Ge 7 4 1 0 2 F pz 5.665 4 -2 0 33 5662 405 2 Ge 8 4 1 1 2 F px 5.665 4 -2 0 34 5663 405 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 -2 0 35 5664 405 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 -2 0 36 5665 405 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 -2 0 37 5666 405 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 -2 0 38 5667 405 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 -2 0 39 5668 406 1 Fe 1 4 0 0 1 F s 9.649 4 -2 0 40 5669 406 1 Fe 2 4 0 0 2 F s 6.885 4 -2 0 41 5670 406 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -2 0 42 5671 406 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -2 0 43 5672 406 1 Fe 5 3 2 0 1 F dz2 6.632 4 -2 0 44 5673 406 1 Fe 6 3 2 1 1 F dxz 6.632 4 -2 0 45 5674 406 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -2 0 46 5675 406 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -2 0 47 5676 406 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -2 0 48 5677 406 1 Fe 10 3 2 0 2 F dz2 2.565 4 -2 0 49 5678 406 1 Fe 11 3 2 1 2 F dxz 2.565 4 -2 0 50 5679 406 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -2 0 51 5680 406 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -2 0 52 5681 406 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -2 0 53 5682 406 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -2 0 54 5683 407 1 Fe 1 4 0 0 1 F s 9.649 4 -2 0 55 5684 407 1 Fe 2 4 0 0 2 F s 6.885 4 -2 0 56 5685 407 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -2 0 57 5686 407 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -2 0 58 5687 407 1 Fe 5 3 2 0 1 F dz2 6.632 4 -2 0 59 5688 407 1 Fe 6 3 2 1 1 F dxz 6.632 4 -2 0 60 5689 407 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -2 0 61 5690 407 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -2 0 62 5691 407 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -2 0 63 5692 407 1 Fe 10 3 2 0 2 F dz2 2.565 4 -2 0 64 5693 407 1 Fe 11 3 2 1 2 F dxz 2.565 4 -2 0 65 5694 407 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -2 0 66 5695 407 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -2 0 67 5696 407 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -2 0 68 5697 407 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -2 0 69 5698 408 1 Fe 1 4 0 0 1 F s 9.649 4 -2 0 70 5699 408 1 Fe 2 4 0 0 2 F s 6.885 4 -2 0 71 5700 408 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -2 0 72 5701 408 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -2 0 73 5702 408 1 Fe 5 3 2 0 1 F dz2 6.632 4 -2 0 74 5703 408 1 Fe 6 3 2 1 1 F dxz 6.632 4 -2 0 75 5704 408 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -2 0 76 5705 408 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -2 0 77 5706 408 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -2 0 78 5707 408 1 Fe 10 3 2 0 2 F dz2 2.565 4 -2 0 79 5708 408 1 Fe 11 3 2 1 2 F dxz 2.565 4 -2 0 80 5709 408 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -2 0 81 5710 408 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -2 0 82 5711 408 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -2 0 83 5712 408 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -2 0 84 5713 409 3 Te 1 5 0 0 1 F s 6.195 -4 -2 0 1 5714 409 3 Te 2 5 0 0 2 F s 4.205 -4 -2 0 2 5715 409 3 Te 3 5 1 -1 1 F py 8.156 -4 -2 0 3 5716 409 3 Te 4 5 1 0 1 F pz 8.156 -4 -2 0 4 5717 409 3 Te 5 5 1 1 1 F px 8.156 -4 -2 0 5 5718 409 3 Te 6 5 1 -1 2 F py 5.009 -4 -2 0 6 5719 409 3 Te 7 5 1 0 2 F pz 5.009 -4 -2 0 7 5720 409 3 Te 8 5 1 1 2 F px 5.009 -4 -2 0 8 5721 409 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -2 0 9 5722 409 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -2 0 10 5723 409 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -2 0 11 5724 409 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -2 0 12 5725 409 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -2 0 13 5726 410 3 Te 1 5 0 0 1 F s 6.195 -4 -2 0 14 5727 410 3 Te 2 5 0 0 2 F s 4.205 -4 -2 0 15 5728 410 3 Te 3 5 1 -1 1 F py 8.156 -4 -2 0 16 5729 410 3 Te 4 5 1 0 1 F pz 8.156 -4 -2 0 17 5730 410 3 Te 5 5 1 1 1 F px 8.156 -4 -2 0 18 5731 410 3 Te 6 5 1 -1 2 F py 5.009 -4 -2 0 19 5732 410 3 Te 7 5 1 0 2 F pz 5.009 -4 -2 0 20 5733 410 3 Te 8 5 1 1 2 F px 5.009 -4 -2 0 21 5734 410 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -2 0 22 5735 410 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -2 0 23 5736 410 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -2 0 24 5737 410 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -2 0 25 5738 410 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -2 0 26 5739 411 2 Ge 1 4 0 0 1 F s 6.581 -4 -2 0 27 5740 411 2 Ge 2 4 0 0 2 F s 4.412 -4 -2 0 28 5741 411 2 Ge 3 4 1 -1 1 F py 9.340 -4 -2 0 29 5742 411 2 Ge 4 4 1 0 1 F pz 9.340 -4 -2 0 30 5743 411 2 Ge 5 4 1 1 1 F px 9.340 -4 -2 0 31 5744 411 2 Ge 6 4 1 -1 2 F py 5.665 -4 -2 0 32 5745 411 2 Ge 7 4 1 0 2 F pz 5.665 -4 -2 0 33 5746 411 2 Ge 8 4 1 1 2 F px 5.665 -4 -2 0 34 5747 411 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 -2 0 35 5748 411 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 -2 0 36 5749 411 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 -2 0 37 5750 411 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 -2 0 38 5751 411 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 -2 0 39 5752 412 1 Fe 1 4 0 0 1 F s 9.649 -4 -2 0 40 5753 412 1 Fe 2 4 0 0 2 F s 6.885 -4 -2 0 41 5754 412 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -2 0 42 5755 412 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -2 0 43 5756 412 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -2 0 44 5757 412 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -2 0 45 5758 412 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -2 0 46 5759 412 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -2 0 47 5760 412 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -2 0 48 5761 412 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -2 0 49 5762 412 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -2 0 50 5763 412 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -2 0 51 5764 412 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -2 0 52 5765 412 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -2 0 53 5766 412 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -2 0 54 5767 413 1 Fe 1 4 0 0 1 F s 9.649 -4 -2 0 55 5768 413 1 Fe 2 4 0 0 2 F s 6.885 -4 -2 0 56 5769 413 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -2 0 57 5770 413 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -2 0 58 5771 413 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -2 0 59 5772 413 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -2 0 60 5773 413 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -2 0 61 5774 413 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -2 0 62 5775 413 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -2 0 63 5776 413 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -2 0 64 5777 413 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -2 0 65 5778 413 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -2 0 66 5779 413 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -2 0 67 5780 413 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -2 0 68 5781 413 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -2 0 69 5782 414 1 Fe 1 4 0 0 1 F s 9.649 -4 -2 0 70 5783 414 1 Fe 2 4 0 0 2 F s 6.885 -4 -2 0 71 5784 414 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -2 0 72 5785 414 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -2 0 73 5786 414 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -2 0 74 5787 414 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -2 0 75 5788 414 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -2 0 76 5789 414 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -2 0 77 5790 414 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -2 0 78 5791 414 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -2 0 79 5792 414 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -2 0 80 5793 414 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -2 0 81 5794 414 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -2 0 82 5795 414 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -2 0 83 5796 414 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -2 0 84 5797 415 3 Te 1 5 0 0 1 F s 6.195 -3 -2 0 1 5798 415 3 Te 2 5 0 0 2 F s 4.205 -3 -2 0 2 5799 415 3 Te 3 5 1 -1 1 F py 8.156 -3 -2 0 3 5800 415 3 Te 4 5 1 0 1 F pz 8.156 -3 -2 0 4 5801 415 3 Te 5 5 1 1 1 F px 8.156 -3 -2 0 5 5802 415 3 Te 6 5 1 -1 2 F py 5.009 -3 -2 0 6 5803 415 3 Te 7 5 1 0 2 F pz 5.009 -3 -2 0 7 5804 415 3 Te 8 5 1 1 2 F px 5.009 -3 -2 0 8 5805 415 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -2 0 9 5806 415 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -2 0 10 5807 415 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -2 0 11 5808 415 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -2 0 12 5809 415 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -2 0 13 5810 416 3 Te 1 5 0 0 1 F s 6.195 -3 -2 0 14 5811 416 3 Te 2 5 0 0 2 F s 4.205 -3 -2 0 15 5812 416 3 Te 3 5 1 -1 1 F py 8.156 -3 -2 0 16 5813 416 3 Te 4 5 1 0 1 F pz 8.156 -3 -2 0 17 5814 416 3 Te 5 5 1 1 1 F px 8.156 -3 -2 0 18 5815 416 3 Te 6 5 1 -1 2 F py 5.009 -3 -2 0 19 5816 416 3 Te 7 5 1 0 2 F pz 5.009 -3 -2 0 20 5817 416 3 Te 8 5 1 1 2 F px 5.009 -3 -2 0 21 5818 416 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -2 0 22 5819 416 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -2 0 23 5820 416 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -2 0 24 5821 416 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -2 0 25 5822 416 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -2 0 26 5823 417 2 Ge 1 4 0 0 1 F s 6.581 -3 -2 0 27 5824 417 2 Ge 2 4 0 0 2 F s 4.412 -3 -2 0 28 5825 417 2 Ge 3 4 1 -1 1 F py 9.340 -3 -2 0 29 5826 417 2 Ge 4 4 1 0 1 F pz 9.340 -3 -2 0 30 5827 417 2 Ge 5 4 1 1 1 F px 9.340 -3 -2 0 31 5828 417 2 Ge 6 4 1 -1 2 F py 5.665 -3 -2 0 32 5829 417 2 Ge 7 4 1 0 2 F pz 5.665 -3 -2 0 33 5830 417 2 Ge 8 4 1 1 2 F px 5.665 -3 -2 0 34 5831 417 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 -2 0 35 5832 417 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 -2 0 36 5833 417 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 -2 0 37 5834 417 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 -2 0 38 5835 417 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 -2 0 39 5836 418 1 Fe 1 4 0 0 1 F s 9.649 -3 -2 0 40 5837 418 1 Fe 2 4 0 0 2 F s 6.885 -3 -2 0 41 5838 418 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -2 0 42 5839 418 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -2 0 43 5840 418 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -2 0 44 5841 418 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -2 0 45 5842 418 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -2 0 46 5843 418 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -2 0 47 5844 418 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -2 0 48 5845 418 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -2 0 49 5846 418 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -2 0 50 5847 418 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -2 0 51 5848 418 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -2 0 52 5849 418 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -2 0 53 5850 418 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -2 0 54 5851 419 1 Fe 1 4 0 0 1 F s 9.649 -3 -2 0 55 5852 419 1 Fe 2 4 0 0 2 F s 6.885 -3 -2 0 56 5853 419 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -2 0 57 5854 419 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -2 0 58 5855 419 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -2 0 59 5856 419 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -2 0 60 5857 419 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -2 0 61 5858 419 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -2 0 62 5859 419 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -2 0 63 5860 419 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -2 0 64 5861 419 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -2 0 65 5862 419 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -2 0 66 5863 419 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -2 0 67 5864 419 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -2 0 68 5865 419 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -2 0 69 5866 420 1 Fe 1 4 0 0 1 F s 9.649 -3 -2 0 70 5867 420 1 Fe 2 4 0 0 2 F s 6.885 -3 -2 0 71 5868 420 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -2 0 72 5869 420 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -2 0 73 5870 420 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -2 0 74 5871 420 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -2 0 75 5872 420 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -2 0 76 5873 420 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -2 0 77 5874 420 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -2 0 78 5875 420 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -2 0 79 5876 420 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -2 0 80 5877 420 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -2 0 81 5878 420 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -2 0 82 5879 420 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -2 0 83 5880 420 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -2 0 84 5881 421 3 Te 1 5 0 0 1 F s 6.195 -2 -2 0 1 5882 421 3 Te 2 5 0 0 2 F s 4.205 -2 -2 0 2 5883 421 3 Te 3 5 1 -1 1 F py 8.156 -2 -2 0 3 5884 421 3 Te 4 5 1 0 1 F pz 8.156 -2 -2 0 4 5885 421 3 Te 5 5 1 1 1 F px 8.156 -2 -2 0 5 5886 421 3 Te 6 5 1 -1 2 F py 5.009 -2 -2 0 6 5887 421 3 Te 7 5 1 0 2 F pz 5.009 -2 -2 0 7 5888 421 3 Te 8 5 1 1 2 F px 5.009 -2 -2 0 8 5889 421 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -2 0 9 5890 421 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -2 0 10 5891 421 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -2 0 11 5892 421 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -2 0 12 5893 421 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -2 0 13 5894 422 3 Te 1 5 0 0 1 F s 6.195 -2 -2 0 14 5895 422 3 Te 2 5 0 0 2 F s 4.205 -2 -2 0 15 5896 422 3 Te 3 5 1 -1 1 F py 8.156 -2 -2 0 16 5897 422 3 Te 4 5 1 0 1 F pz 8.156 -2 -2 0 17 5898 422 3 Te 5 5 1 1 1 F px 8.156 -2 -2 0 18 5899 422 3 Te 6 5 1 -1 2 F py 5.009 -2 -2 0 19 5900 422 3 Te 7 5 1 0 2 F pz 5.009 -2 -2 0 20 5901 422 3 Te 8 5 1 1 2 F px 5.009 -2 -2 0 21 5902 422 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -2 0 22 5903 422 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -2 0 23 5904 422 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -2 0 24 5905 422 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -2 0 25 5906 422 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -2 0 26 5907 423 2 Ge 1 4 0 0 1 F s 6.581 -2 -2 0 27 5908 423 2 Ge 2 4 0 0 2 F s 4.412 -2 -2 0 28 5909 423 2 Ge 3 4 1 -1 1 F py 9.340 -2 -2 0 29 5910 423 2 Ge 4 4 1 0 1 F pz 9.340 -2 -2 0 30 5911 423 2 Ge 5 4 1 1 1 F px 9.340 -2 -2 0 31 5912 423 2 Ge 6 4 1 -1 2 F py 5.665 -2 -2 0 32 5913 423 2 Ge 7 4 1 0 2 F pz 5.665 -2 -2 0 33 5914 423 2 Ge 8 4 1 1 2 F px 5.665 -2 -2 0 34 5915 423 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 -2 0 35 5916 423 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 -2 0 36 5917 423 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 -2 0 37 5918 423 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 -2 0 38 5919 423 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 -2 0 39 5920 424 1 Fe 1 4 0 0 1 F s 9.649 -2 -2 0 40 5921 424 1 Fe 2 4 0 0 2 F s 6.885 -2 -2 0 41 5922 424 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -2 0 42 5923 424 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -2 0 43 5924 424 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -2 0 44 5925 424 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -2 0 45 5926 424 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -2 0 46 5927 424 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -2 0 47 5928 424 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -2 0 48 5929 424 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -2 0 49 5930 424 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -2 0 50 5931 424 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -2 0 51 5932 424 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -2 0 52 5933 424 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -2 0 53 5934 424 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -2 0 54 5935 425 1 Fe 1 4 0 0 1 F s 9.649 -2 -2 0 55 5936 425 1 Fe 2 4 0 0 2 F s 6.885 -2 -2 0 56 5937 425 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -2 0 57 5938 425 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -2 0 58 5939 425 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -2 0 59 5940 425 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -2 0 60 5941 425 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -2 0 61 5942 425 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -2 0 62 5943 425 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -2 0 63 5944 425 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -2 0 64 5945 425 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -2 0 65 5946 425 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -2 0 66 5947 425 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -2 0 67 5948 425 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -2 0 68 5949 425 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -2 0 69 5950 426 1 Fe 1 4 0 0 1 F s 9.649 -2 -2 0 70 5951 426 1 Fe 2 4 0 0 2 F s 6.885 -2 -2 0 71 5952 426 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -2 0 72 5953 426 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -2 0 73 5954 426 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -2 0 74 5955 426 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -2 0 75 5956 426 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -2 0 76 5957 426 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -2 0 77 5958 426 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -2 0 78 5959 426 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -2 0 79 5960 426 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -2 0 80 5961 426 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -2 0 81 5962 426 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -2 0 82 5963 426 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -2 0 83 5964 426 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -2 0 84 5965 427 3 Te 1 5 0 0 1 F s 6.195 -1 -2 0 1 5966 427 3 Te 2 5 0 0 2 F s 4.205 -1 -2 0 2 5967 427 3 Te 3 5 1 -1 1 F py 8.156 -1 -2 0 3 5968 427 3 Te 4 5 1 0 1 F pz 8.156 -1 -2 0 4 5969 427 3 Te 5 5 1 1 1 F px 8.156 -1 -2 0 5 5970 427 3 Te 6 5 1 -1 2 F py 5.009 -1 -2 0 6 5971 427 3 Te 7 5 1 0 2 F pz 5.009 -1 -2 0 7 5972 427 3 Te 8 5 1 1 2 F px 5.009 -1 -2 0 8 5973 427 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -2 0 9 5974 427 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -2 0 10 5975 427 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -2 0 11 5976 427 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -2 0 12 5977 427 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -2 0 13 5978 428 3 Te 1 5 0 0 1 F s 6.195 -1 -2 0 14 5979 428 3 Te 2 5 0 0 2 F s 4.205 -1 -2 0 15 5980 428 3 Te 3 5 1 -1 1 F py 8.156 -1 -2 0 16 5981 428 3 Te 4 5 1 0 1 F pz 8.156 -1 -2 0 17 5982 428 3 Te 5 5 1 1 1 F px 8.156 -1 -2 0 18 5983 428 3 Te 6 5 1 -1 2 F py 5.009 -1 -2 0 19 5984 428 3 Te 7 5 1 0 2 F pz 5.009 -1 -2 0 20 5985 428 3 Te 8 5 1 1 2 F px 5.009 -1 -2 0 21 5986 428 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -2 0 22 5987 428 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -2 0 23 5988 428 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -2 0 24 5989 428 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -2 0 25 5990 428 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -2 0 26 5991 429 2 Ge 1 4 0 0 1 F s 6.581 -1 -2 0 27 5992 429 2 Ge 2 4 0 0 2 F s 4.412 -1 -2 0 28 5993 429 2 Ge 3 4 1 -1 1 F py 9.340 -1 -2 0 29 5994 429 2 Ge 4 4 1 0 1 F pz 9.340 -1 -2 0 30 5995 429 2 Ge 5 4 1 1 1 F px 9.340 -1 -2 0 31 5996 429 2 Ge 6 4 1 -1 2 F py 5.665 -1 -2 0 32 5997 429 2 Ge 7 4 1 0 2 F pz 5.665 -1 -2 0 33 5998 429 2 Ge 8 4 1 1 2 F px 5.665 -1 -2 0 34 5999 429 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 -2 0 35 6000 429 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 -2 0 36 6001 429 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 -2 0 37 6002 429 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 -2 0 38 6003 429 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 -2 0 39 6004 430 1 Fe 1 4 0 0 1 F s 9.649 -1 -2 0 40 6005 430 1 Fe 2 4 0 0 2 F s 6.885 -1 -2 0 41 6006 430 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -2 0 42 6007 430 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -2 0 43 6008 430 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -2 0 44 6009 430 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -2 0 45 6010 430 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -2 0 46 6011 430 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -2 0 47 6012 430 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -2 0 48 6013 430 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -2 0 49 6014 430 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -2 0 50 6015 430 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -2 0 51 6016 430 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -2 0 52 6017 430 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -2 0 53 6018 430 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -2 0 54 6019 431 1 Fe 1 4 0 0 1 F s 9.649 -1 -2 0 55 6020 431 1 Fe 2 4 0 0 2 F s 6.885 -1 -2 0 56 6021 431 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -2 0 57 6022 431 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -2 0 58 6023 431 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -2 0 59 6024 431 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -2 0 60 6025 431 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -2 0 61 6026 431 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -2 0 62 6027 431 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -2 0 63 6028 431 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -2 0 64 6029 431 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -2 0 65 6030 431 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -2 0 66 6031 431 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -2 0 67 6032 431 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -2 0 68 6033 431 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -2 0 69 6034 432 1 Fe 1 4 0 0 1 F s 9.649 -1 -2 0 70 6035 432 1 Fe 2 4 0 0 2 F s 6.885 -1 -2 0 71 6036 432 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -2 0 72 6037 432 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -2 0 73 6038 432 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -2 0 74 6039 432 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -2 0 75 6040 432 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -2 0 76 6041 432 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -2 0 77 6042 432 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -2 0 78 6043 432 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -2 0 79 6044 432 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -2 0 80 6045 432 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -2 0 81 6046 432 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -2 0 82 6047 432 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -2 0 83 6048 432 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -2 0 84 6049 433 3 Te 1 5 0 0 1 F s 6.195 0 -1 0 1 6050 433 3 Te 2 5 0 0 2 F s 4.205 0 -1 0 2 6051 433 3 Te 3 5 1 -1 1 F py 8.156 0 -1 0 3 6052 433 3 Te 4 5 1 0 1 F pz 8.156 0 -1 0 4 6053 433 3 Te 5 5 1 1 1 F px 8.156 0 -1 0 5 6054 433 3 Te 6 5 1 -1 2 F py 5.009 0 -1 0 6 6055 433 3 Te 7 5 1 0 2 F pz 5.009 0 -1 0 7 6056 433 3 Te 8 5 1 1 2 F px 5.009 0 -1 0 8 6057 433 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -1 0 9 6058 433 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -1 0 10 6059 433 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -1 0 11 6060 433 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -1 0 12 6061 433 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -1 0 13 6062 434 3 Te 1 5 0 0 1 F s 6.195 0 -1 0 14 6063 434 3 Te 2 5 0 0 2 F s 4.205 0 -1 0 15 6064 434 3 Te 3 5 1 -1 1 F py 8.156 0 -1 0 16 6065 434 3 Te 4 5 1 0 1 F pz 8.156 0 -1 0 17 6066 434 3 Te 5 5 1 1 1 F px 8.156 0 -1 0 18 6067 434 3 Te 6 5 1 -1 2 F py 5.009 0 -1 0 19 6068 434 3 Te 7 5 1 0 2 F pz 5.009 0 -1 0 20 6069 434 3 Te 8 5 1 1 2 F px 5.009 0 -1 0 21 6070 434 3 Te 9 5 2 -2 1 T Pdxy 8.156 0 -1 0 22 6071 434 3 Te 10 5 2 -1 1 T Pdyz 8.156 0 -1 0 23 6072 434 3 Te 11 5 2 0 1 T Pdz2 8.156 0 -1 0 24 6073 434 3 Te 12 5 2 1 1 T Pdxz 8.156 0 -1 0 25 6074 434 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 0 -1 0 26 6075 435 2 Ge 1 4 0 0 1 F s 6.581 0 -1 0 27 6076 435 2 Ge 2 4 0 0 2 F s 4.412 0 -1 0 28 6077 435 2 Ge 3 4 1 -1 1 F py 9.340 0 -1 0 29 6078 435 2 Ge 4 4 1 0 1 F pz 9.340 0 -1 0 30 6079 435 2 Ge 5 4 1 1 1 F px 9.340 0 -1 0 31 6080 435 2 Ge 6 4 1 -1 2 F py 5.665 0 -1 0 32 6081 435 2 Ge 7 4 1 0 2 F pz 5.665 0 -1 0 33 6082 435 2 Ge 8 4 1 1 2 F px 5.665 0 -1 0 34 6083 435 2 Ge 9 4 2 -2 1 T Pdxy 9.340 0 -1 0 35 6084 435 2 Ge 10 4 2 -1 1 T Pdyz 9.340 0 -1 0 36 6085 435 2 Ge 11 4 2 0 1 T Pdz2 9.340 0 -1 0 37 6086 435 2 Ge 12 4 2 1 1 T Pdxz 9.340 0 -1 0 38 6087 435 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 0 -1 0 39 6088 436 1 Fe 1 4 0 0 1 F s 9.649 0 -1 0 40 6089 436 1 Fe 2 4 0 0 2 F s 6.885 0 -1 0 41 6090 436 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -1 0 42 6091 436 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -1 0 43 6092 436 1 Fe 5 3 2 0 1 F dz2 6.632 0 -1 0 44 6093 436 1 Fe 6 3 2 1 1 F dxz 6.632 0 -1 0 45 6094 436 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -1 0 46 6095 436 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -1 0 47 6096 436 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -1 0 48 6097 436 1 Fe 10 3 2 0 2 F dz2 2.565 0 -1 0 49 6098 436 1 Fe 11 3 2 1 2 F dxz 2.565 0 -1 0 50 6099 436 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -1 0 51 6100 436 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -1 0 52 6101 436 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -1 0 53 6102 436 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -1 0 54 6103 437 1 Fe 1 4 0 0 1 F s 9.649 0 -1 0 55 6104 437 1 Fe 2 4 0 0 2 F s 6.885 0 -1 0 56 6105 437 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -1 0 57 6106 437 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -1 0 58 6107 437 1 Fe 5 3 2 0 1 F dz2 6.632 0 -1 0 59 6108 437 1 Fe 6 3 2 1 1 F dxz 6.632 0 -1 0 60 6109 437 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -1 0 61 6110 437 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -1 0 62 6111 437 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -1 0 63 6112 437 1 Fe 10 3 2 0 2 F dz2 2.565 0 -1 0 64 6113 437 1 Fe 11 3 2 1 2 F dxz 2.565 0 -1 0 65 6114 437 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -1 0 66 6115 437 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -1 0 67 6116 437 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -1 0 68 6117 437 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -1 0 69 6118 438 1 Fe 1 4 0 0 1 F s 9.649 0 -1 0 70 6119 438 1 Fe 2 4 0 0 2 F s 6.885 0 -1 0 71 6120 438 1 Fe 3 3 2 -2 1 F dxy 6.632 0 -1 0 72 6121 438 1 Fe 4 3 2 -1 1 F dyz 6.632 0 -1 0 73 6122 438 1 Fe 5 3 2 0 1 F dz2 6.632 0 -1 0 74 6123 438 1 Fe 6 3 2 1 1 F dxz 6.632 0 -1 0 75 6124 438 1 Fe 7 3 2 2 1 F dx2-y2 6.632 0 -1 0 76 6125 438 1 Fe 8 3 2 -2 2 F dxy 2.565 0 -1 0 77 6126 438 1 Fe 9 3 2 -1 2 F dyz 2.565 0 -1 0 78 6127 438 1 Fe 10 3 2 0 2 F dz2 2.565 0 -1 0 79 6128 438 1 Fe 11 3 2 1 2 F dxz 2.565 0 -1 0 80 6129 438 1 Fe 12 3 2 2 2 F dx2-y2 2.565 0 -1 0 81 6130 438 1 Fe 13 4 1 -1 1 T Ppy 9.649 0 -1 0 82 6131 438 1 Fe 14 4 1 0 1 T Ppz 9.649 0 -1 0 83 6132 438 1 Fe 15 4 1 1 1 T Ppx 9.649 0 -1 0 84 6133 439 3 Te 1 5 0 0 1 F s 6.195 1 -1 0 1 6134 439 3 Te 2 5 0 0 2 F s 4.205 1 -1 0 2 6135 439 3 Te 3 5 1 -1 1 F py 8.156 1 -1 0 3 6136 439 3 Te 4 5 1 0 1 F pz 8.156 1 -1 0 4 6137 439 3 Te 5 5 1 1 1 F px 8.156 1 -1 0 5 6138 439 3 Te 6 5 1 -1 2 F py 5.009 1 -1 0 6 6139 439 3 Te 7 5 1 0 2 F pz 5.009 1 -1 0 7 6140 439 3 Te 8 5 1 1 2 F px 5.009 1 -1 0 8 6141 439 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -1 0 9 6142 439 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -1 0 10 6143 439 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -1 0 11 6144 439 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -1 0 12 6145 439 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -1 0 13 6146 440 3 Te 1 5 0 0 1 F s 6.195 1 -1 0 14 6147 440 3 Te 2 5 0 0 2 F s 4.205 1 -1 0 15 6148 440 3 Te 3 5 1 -1 1 F py 8.156 1 -1 0 16 6149 440 3 Te 4 5 1 0 1 F pz 8.156 1 -1 0 17 6150 440 3 Te 5 5 1 1 1 F px 8.156 1 -1 0 18 6151 440 3 Te 6 5 1 -1 2 F py 5.009 1 -1 0 19 6152 440 3 Te 7 5 1 0 2 F pz 5.009 1 -1 0 20 6153 440 3 Te 8 5 1 1 2 F px 5.009 1 -1 0 21 6154 440 3 Te 9 5 2 -2 1 T Pdxy 8.156 1 -1 0 22 6155 440 3 Te 10 5 2 -1 1 T Pdyz 8.156 1 -1 0 23 6156 440 3 Te 11 5 2 0 1 T Pdz2 8.156 1 -1 0 24 6157 440 3 Te 12 5 2 1 1 T Pdxz 8.156 1 -1 0 25 6158 440 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 1 -1 0 26 6159 441 2 Ge 1 4 0 0 1 F s 6.581 1 -1 0 27 6160 441 2 Ge 2 4 0 0 2 F s 4.412 1 -1 0 28 6161 441 2 Ge 3 4 1 -1 1 F py 9.340 1 -1 0 29 6162 441 2 Ge 4 4 1 0 1 F pz 9.340 1 -1 0 30 6163 441 2 Ge 5 4 1 1 1 F px 9.340 1 -1 0 31 6164 441 2 Ge 6 4 1 -1 2 F py 5.665 1 -1 0 32 6165 441 2 Ge 7 4 1 0 2 F pz 5.665 1 -1 0 33 6166 441 2 Ge 8 4 1 1 2 F px 5.665 1 -1 0 34 6167 441 2 Ge 9 4 2 -2 1 T Pdxy 9.340 1 -1 0 35 6168 441 2 Ge 10 4 2 -1 1 T Pdyz 9.340 1 -1 0 36 6169 441 2 Ge 11 4 2 0 1 T Pdz2 9.340 1 -1 0 37 6170 441 2 Ge 12 4 2 1 1 T Pdxz 9.340 1 -1 0 38 6171 441 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 1 -1 0 39 6172 442 1 Fe 1 4 0 0 1 F s 9.649 1 -1 0 40 6173 442 1 Fe 2 4 0 0 2 F s 6.885 1 -1 0 41 6174 442 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -1 0 42 6175 442 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -1 0 43 6176 442 1 Fe 5 3 2 0 1 F dz2 6.632 1 -1 0 44 6177 442 1 Fe 6 3 2 1 1 F dxz 6.632 1 -1 0 45 6178 442 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -1 0 46 6179 442 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -1 0 47 6180 442 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -1 0 48 6181 442 1 Fe 10 3 2 0 2 F dz2 2.565 1 -1 0 49 6182 442 1 Fe 11 3 2 1 2 F dxz 2.565 1 -1 0 50 6183 442 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -1 0 51 6184 442 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -1 0 52 6185 442 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -1 0 53 6186 442 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -1 0 54 6187 443 1 Fe 1 4 0 0 1 F s 9.649 1 -1 0 55 6188 443 1 Fe 2 4 0 0 2 F s 6.885 1 -1 0 56 6189 443 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -1 0 57 6190 443 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -1 0 58 6191 443 1 Fe 5 3 2 0 1 F dz2 6.632 1 -1 0 59 6192 443 1 Fe 6 3 2 1 1 F dxz 6.632 1 -1 0 60 6193 443 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -1 0 61 6194 443 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -1 0 62 6195 443 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -1 0 63 6196 443 1 Fe 10 3 2 0 2 F dz2 2.565 1 -1 0 64 6197 443 1 Fe 11 3 2 1 2 F dxz 2.565 1 -1 0 65 6198 443 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -1 0 66 6199 443 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -1 0 67 6200 443 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -1 0 68 6201 443 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -1 0 69 6202 444 1 Fe 1 4 0 0 1 F s 9.649 1 -1 0 70 6203 444 1 Fe 2 4 0 0 2 F s 6.885 1 -1 0 71 6204 444 1 Fe 3 3 2 -2 1 F dxy 6.632 1 -1 0 72 6205 444 1 Fe 4 3 2 -1 1 F dyz 6.632 1 -1 0 73 6206 444 1 Fe 5 3 2 0 1 F dz2 6.632 1 -1 0 74 6207 444 1 Fe 6 3 2 1 1 F dxz 6.632 1 -1 0 75 6208 444 1 Fe 7 3 2 2 1 F dx2-y2 6.632 1 -1 0 76 6209 444 1 Fe 8 3 2 -2 2 F dxy 2.565 1 -1 0 77 6210 444 1 Fe 9 3 2 -1 2 F dyz 2.565 1 -1 0 78 6211 444 1 Fe 10 3 2 0 2 F dz2 2.565 1 -1 0 79 6212 444 1 Fe 11 3 2 1 2 F dxz 2.565 1 -1 0 80 6213 444 1 Fe 12 3 2 2 2 F dx2-y2 2.565 1 -1 0 81 6214 444 1 Fe 13 4 1 -1 1 T Ppy 9.649 1 -1 0 82 6215 444 1 Fe 14 4 1 0 1 T Ppz 9.649 1 -1 0 83 6216 444 1 Fe 15 4 1 1 1 T Ppx 9.649 1 -1 0 84 6217 445 3 Te 1 5 0 0 1 F s 6.195 2 -1 0 1 6218 445 3 Te 2 5 0 0 2 F s 4.205 2 -1 0 2 6219 445 3 Te 3 5 1 -1 1 F py 8.156 2 -1 0 3 6220 445 3 Te 4 5 1 0 1 F pz 8.156 2 -1 0 4 6221 445 3 Te 5 5 1 1 1 F px 8.156 2 -1 0 5 6222 445 3 Te 6 5 1 -1 2 F py 5.009 2 -1 0 6 6223 445 3 Te 7 5 1 0 2 F pz 5.009 2 -1 0 7 6224 445 3 Te 8 5 1 1 2 F px 5.009 2 -1 0 8 6225 445 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -1 0 9 6226 445 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -1 0 10 6227 445 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -1 0 11 6228 445 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -1 0 12 6229 445 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -1 0 13 6230 446 3 Te 1 5 0 0 1 F s 6.195 2 -1 0 14 6231 446 3 Te 2 5 0 0 2 F s 4.205 2 -1 0 15 6232 446 3 Te 3 5 1 -1 1 F py 8.156 2 -1 0 16 6233 446 3 Te 4 5 1 0 1 F pz 8.156 2 -1 0 17 6234 446 3 Te 5 5 1 1 1 F px 8.156 2 -1 0 18 6235 446 3 Te 6 5 1 -1 2 F py 5.009 2 -1 0 19 6236 446 3 Te 7 5 1 0 2 F pz 5.009 2 -1 0 20 6237 446 3 Te 8 5 1 1 2 F px 5.009 2 -1 0 21 6238 446 3 Te 9 5 2 -2 1 T Pdxy 8.156 2 -1 0 22 6239 446 3 Te 10 5 2 -1 1 T Pdyz 8.156 2 -1 0 23 6240 446 3 Te 11 5 2 0 1 T Pdz2 8.156 2 -1 0 24 6241 446 3 Te 12 5 2 1 1 T Pdxz 8.156 2 -1 0 25 6242 446 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 2 -1 0 26 6243 447 2 Ge 1 4 0 0 1 F s 6.581 2 -1 0 27 6244 447 2 Ge 2 4 0 0 2 F s 4.412 2 -1 0 28 6245 447 2 Ge 3 4 1 -1 1 F py 9.340 2 -1 0 29 6246 447 2 Ge 4 4 1 0 1 F pz 9.340 2 -1 0 30 6247 447 2 Ge 5 4 1 1 1 F px 9.340 2 -1 0 31 6248 447 2 Ge 6 4 1 -1 2 F py 5.665 2 -1 0 32 6249 447 2 Ge 7 4 1 0 2 F pz 5.665 2 -1 0 33 6250 447 2 Ge 8 4 1 1 2 F px 5.665 2 -1 0 34 6251 447 2 Ge 9 4 2 -2 1 T Pdxy 9.340 2 -1 0 35 6252 447 2 Ge 10 4 2 -1 1 T Pdyz 9.340 2 -1 0 36 6253 447 2 Ge 11 4 2 0 1 T Pdz2 9.340 2 -1 0 37 6254 447 2 Ge 12 4 2 1 1 T Pdxz 9.340 2 -1 0 38 6255 447 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 2 -1 0 39 6256 448 1 Fe 1 4 0 0 1 F s 9.649 2 -1 0 40 6257 448 1 Fe 2 4 0 0 2 F s 6.885 2 -1 0 41 6258 448 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -1 0 42 6259 448 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -1 0 43 6260 448 1 Fe 5 3 2 0 1 F dz2 6.632 2 -1 0 44 6261 448 1 Fe 6 3 2 1 1 F dxz 6.632 2 -1 0 45 6262 448 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -1 0 46 6263 448 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -1 0 47 6264 448 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -1 0 48 6265 448 1 Fe 10 3 2 0 2 F dz2 2.565 2 -1 0 49 6266 448 1 Fe 11 3 2 1 2 F dxz 2.565 2 -1 0 50 6267 448 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -1 0 51 6268 448 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -1 0 52 6269 448 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -1 0 53 6270 448 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -1 0 54 6271 449 1 Fe 1 4 0 0 1 F s 9.649 2 -1 0 55 6272 449 1 Fe 2 4 0 0 2 F s 6.885 2 -1 0 56 6273 449 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -1 0 57 6274 449 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -1 0 58 6275 449 1 Fe 5 3 2 0 1 F dz2 6.632 2 -1 0 59 6276 449 1 Fe 6 3 2 1 1 F dxz 6.632 2 -1 0 60 6277 449 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -1 0 61 6278 449 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -1 0 62 6279 449 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -1 0 63 6280 449 1 Fe 10 3 2 0 2 F dz2 2.565 2 -1 0 64 6281 449 1 Fe 11 3 2 1 2 F dxz 2.565 2 -1 0 65 6282 449 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -1 0 66 6283 449 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -1 0 67 6284 449 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -1 0 68 6285 449 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -1 0 69 6286 450 1 Fe 1 4 0 0 1 F s 9.649 2 -1 0 70 6287 450 1 Fe 2 4 0 0 2 F s 6.885 2 -1 0 71 6288 450 1 Fe 3 3 2 -2 1 F dxy 6.632 2 -1 0 72 6289 450 1 Fe 4 3 2 -1 1 F dyz 6.632 2 -1 0 73 6290 450 1 Fe 5 3 2 0 1 F dz2 6.632 2 -1 0 74 6291 450 1 Fe 6 3 2 1 1 F dxz 6.632 2 -1 0 75 6292 450 1 Fe 7 3 2 2 1 F dx2-y2 6.632 2 -1 0 76 6293 450 1 Fe 8 3 2 -2 2 F dxy 2.565 2 -1 0 77 6294 450 1 Fe 9 3 2 -1 2 F dyz 2.565 2 -1 0 78 6295 450 1 Fe 10 3 2 0 2 F dz2 2.565 2 -1 0 79 6296 450 1 Fe 11 3 2 1 2 F dxz 2.565 2 -1 0 80 6297 450 1 Fe 12 3 2 2 2 F dx2-y2 2.565 2 -1 0 81 6298 450 1 Fe 13 4 1 -1 1 T Ppy 9.649 2 -1 0 82 6299 450 1 Fe 14 4 1 0 1 T Ppz 9.649 2 -1 0 83 6300 450 1 Fe 15 4 1 1 1 T Ppx 9.649 2 -1 0 84 6301 451 3 Te 1 5 0 0 1 F s 6.195 3 -1 0 1 6302 451 3 Te 2 5 0 0 2 F s 4.205 3 -1 0 2 6303 451 3 Te 3 5 1 -1 1 F py 8.156 3 -1 0 3 6304 451 3 Te 4 5 1 0 1 F pz 8.156 3 -1 0 4 6305 451 3 Te 5 5 1 1 1 F px 8.156 3 -1 0 5 6306 451 3 Te 6 5 1 -1 2 F py 5.009 3 -1 0 6 6307 451 3 Te 7 5 1 0 2 F pz 5.009 3 -1 0 7 6308 451 3 Te 8 5 1 1 2 F px 5.009 3 -1 0 8 6309 451 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -1 0 9 6310 451 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -1 0 10 6311 451 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -1 0 11 6312 451 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -1 0 12 6313 451 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -1 0 13 6314 452 3 Te 1 5 0 0 1 F s 6.195 3 -1 0 14 6315 452 3 Te 2 5 0 0 2 F s 4.205 3 -1 0 15 6316 452 3 Te 3 5 1 -1 1 F py 8.156 3 -1 0 16 6317 452 3 Te 4 5 1 0 1 F pz 8.156 3 -1 0 17 6318 452 3 Te 5 5 1 1 1 F px 8.156 3 -1 0 18 6319 452 3 Te 6 5 1 -1 2 F py 5.009 3 -1 0 19 6320 452 3 Te 7 5 1 0 2 F pz 5.009 3 -1 0 20 6321 452 3 Te 8 5 1 1 2 F px 5.009 3 -1 0 21 6322 452 3 Te 9 5 2 -2 1 T Pdxy 8.156 3 -1 0 22 6323 452 3 Te 10 5 2 -1 1 T Pdyz 8.156 3 -1 0 23 6324 452 3 Te 11 5 2 0 1 T Pdz2 8.156 3 -1 0 24 6325 452 3 Te 12 5 2 1 1 T Pdxz 8.156 3 -1 0 25 6326 452 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 3 -1 0 26 6327 453 2 Ge 1 4 0 0 1 F s 6.581 3 -1 0 27 6328 453 2 Ge 2 4 0 0 2 F s 4.412 3 -1 0 28 6329 453 2 Ge 3 4 1 -1 1 F py 9.340 3 -1 0 29 6330 453 2 Ge 4 4 1 0 1 F pz 9.340 3 -1 0 30 6331 453 2 Ge 5 4 1 1 1 F px 9.340 3 -1 0 31 6332 453 2 Ge 6 4 1 -1 2 F py 5.665 3 -1 0 32 6333 453 2 Ge 7 4 1 0 2 F pz 5.665 3 -1 0 33 6334 453 2 Ge 8 4 1 1 2 F px 5.665 3 -1 0 34 6335 453 2 Ge 9 4 2 -2 1 T Pdxy 9.340 3 -1 0 35 6336 453 2 Ge 10 4 2 -1 1 T Pdyz 9.340 3 -1 0 36 6337 453 2 Ge 11 4 2 0 1 T Pdz2 9.340 3 -1 0 37 6338 453 2 Ge 12 4 2 1 1 T Pdxz 9.340 3 -1 0 38 6339 453 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 3 -1 0 39 6340 454 1 Fe 1 4 0 0 1 F s 9.649 3 -1 0 40 6341 454 1 Fe 2 4 0 0 2 F s 6.885 3 -1 0 41 6342 454 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -1 0 42 6343 454 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -1 0 43 6344 454 1 Fe 5 3 2 0 1 F dz2 6.632 3 -1 0 44 6345 454 1 Fe 6 3 2 1 1 F dxz 6.632 3 -1 0 45 6346 454 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -1 0 46 6347 454 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -1 0 47 6348 454 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -1 0 48 6349 454 1 Fe 10 3 2 0 2 F dz2 2.565 3 -1 0 49 6350 454 1 Fe 11 3 2 1 2 F dxz 2.565 3 -1 0 50 6351 454 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -1 0 51 6352 454 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -1 0 52 6353 454 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -1 0 53 6354 454 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -1 0 54 6355 455 1 Fe 1 4 0 0 1 F s 9.649 3 -1 0 55 6356 455 1 Fe 2 4 0 0 2 F s 6.885 3 -1 0 56 6357 455 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -1 0 57 6358 455 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -1 0 58 6359 455 1 Fe 5 3 2 0 1 F dz2 6.632 3 -1 0 59 6360 455 1 Fe 6 3 2 1 1 F dxz 6.632 3 -1 0 60 6361 455 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -1 0 61 6362 455 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -1 0 62 6363 455 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -1 0 63 6364 455 1 Fe 10 3 2 0 2 F dz2 2.565 3 -1 0 64 6365 455 1 Fe 11 3 2 1 2 F dxz 2.565 3 -1 0 65 6366 455 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -1 0 66 6367 455 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -1 0 67 6368 455 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -1 0 68 6369 455 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -1 0 69 6370 456 1 Fe 1 4 0 0 1 F s 9.649 3 -1 0 70 6371 456 1 Fe 2 4 0 0 2 F s 6.885 3 -1 0 71 6372 456 1 Fe 3 3 2 -2 1 F dxy 6.632 3 -1 0 72 6373 456 1 Fe 4 3 2 -1 1 F dyz 6.632 3 -1 0 73 6374 456 1 Fe 5 3 2 0 1 F dz2 6.632 3 -1 0 74 6375 456 1 Fe 6 3 2 1 1 F dxz 6.632 3 -1 0 75 6376 456 1 Fe 7 3 2 2 1 F dx2-y2 6.632 3 -1 0 76 6377 456 1 Fe 8 3 2 -2 2 F dxy 2.565 3 -1 0 77 6378 456 1 Fe 9 3 2 -1 2 F dyz 2.565 3 -1 0 78 6379 456 1 Fe 10 3 2 0 2 F dz2 2.565 3 -1 0 79 6380 456 1 Fe 11 3 2 1 2 F dxz 2.565 3 -1 0 80 6381 456 1 Fe 12 3 2 2 2 F dx2-y2 2.565 3 -1 0 81 6382 456 1 Fe 13 4 1 -1 1 T Ppy 9.649 3 -1 0 82 6383 456 1 Fe 14 4 1 0 1 T Ppz 9.649 3 -1 0 83 6384 456 1 Fe 15 4 1 1 1 T Ppx 9.649 3 -1 0 84 6385 457 3 Te 1 5 0 0 1 F s 6.195 4 -1 0 1 6386 457 3 Te 2 5 0 0 2 F s 4.205 4 -1 0 2 6387 457 3 Te 3 5 1 -1 1 F py 8.156 4 -1 0 3 6388 457 3 Te 4 5 1 0 1 F pz 8.156 4 -1 0 4 6389 457 3 Te 5 5 1 1 1 F px 8.156 4 -1 0 5 6390 457 3 Te 6 5 1 -1 2 F py 5.009 4 -1 0 6 6391 457 3 Te 7 5 1 0 2 F pz 5.009 4 -1 0 7 6392 457 3 Te 8 5 1 1 2 F px 5.009 4 -1 0 8 6393 457 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -1 0 9 6394 457 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -1 0 10 6395 457 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -1 0 11 6396 457 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -1 0 12 6397 457 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -1 0 13 6398 458 3 Te 1 5 0 0 1 F s 6.195 4 -1 0 14 6399 458 3 Te 2 5 0 0 2 F s 4.205 4 -1 0 15 6400 458 3 Te 3 5 1 -1 1 F py 8.156 4 -1 0 16 6401 458 3 Te 4 5 1 0 1 F pz 8.156 4 -1 0 17 6402 458 3 Te 5 5 1 1 1 F px 8.156 4 -1 0 18 6403 458 3 Te 6 5 1 -1 2 F py 5.009 4 -1 0 19 6404 458 3 Te 7 5 1 0 2 F pz 5.009 4 -1 0 20 6405 458 3 Te 8 5 1 1 2 F px 5.009 4 -1 0 21 6406 458 3 Te 9 5 2 -2 1 T Pdxy 8.156 4 -1 0 22 6407 458 3 Te 10 5 2 -1 1 T Pdyz 8.156 4 -1 0 23 6408 458 3 Te 11 5 2 0 1 T Pdz2 8.156 4 -1 0 24 6409 458 3 Te 12 5 2 1 1 T Pdxz 8.156 4 -1 0 25 6410 458 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 4 -1 0 26 6411 459 2 Ge 1 4 0 0 1 F s 6.581 4 -1 0 27 6412 459 2 Ge 2 4 0 0 2 F s 4.412 4 -1 0 28 6413 459 2 Ge 3 4 1 -1 1 F py 9.340 4 -1 0 29 6414 459 2 Ge 4 4 1 0 1 F pz 9.340 4 -1 0 30 6415 459 2 Ge 5 4 1 1 1 F px 9.340 4 -1 0 31 6416 459 2 Ge 6 4 1 -1 2 F py 5.665 4 -1 0 32 6417 459 2 Ge 7 4 1 0 2 F pz 5.665 4 -1 0 33 6418 459 2 Ge 8 4 1 1 2 F px 5.665 4 -1 0 34 6419 459 2 Ge 9 4 2 -2 1 T Pdxy 9.340 4 -1 0 35 6420 459 2 Ge 10 4 2 -1 1 T Pdyz 9.340 4 -1 0 36 6421 459 2 Ge 11 4 2 0 1 T Pdz2 9.340 4 -1 0 37 6422 459 2 Ge 12 4 2 1 1 T Pdxz 9.340 4 -1 0 38 6423 459 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 4 -1 0 39 6424 460 1 Fe 1 4 0 0 1 F s 9.649 4 -1 0 40 6425 460 1 Fe 2 4 0 0 2 F s 6.885 4 -1 0 41 6426 460 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -1 0 42 6427 460 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -1 0 43 6428 460 1 Fe 5 3 2 0 1 F dz2 6.632 4 -1 0 44 6429 460 1 Fe 6 3 2 1 1 F dxz 6.632 4 -1 0 45 6430 460 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -1 0 46 6431 460 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -1 0 47 6432 460 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -1 0 48 6433 460 1 Fe 10 3 2 0 2 F dz2 2.565 4 -1 0 49 6434 460 1 Fe 11 3 2 1 2 F dxz 2.565 4 -1 0 50 6435 460 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -1 0 51 6436 460 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -1 0 52 6437 460 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -1 0 53 6438 460 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -1 0 54 6439 461 1 Fe 1 4 0 0 1 F s 9.649 4 -1 0 55 6440 461 1 Fe 2 4 0 0 2 F s 6.885 4 -1 0 56 6441 461 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -1 0 57 6442 461 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -1 0 58 6443 461 1 Fe 5 3 2 0 1 F dz2 6.632 4 -1 0 59 6444 461 1 Fe 6 3 2 1 1 F dxz 6.632 4 -1 0 60 6445 461 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -1 0 61 6446 461 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -1 0 62 6447 461 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -1 0 63 6448 461 1 Fe 10 3 2 0 2 F dz2 2.565 4 -1 0 64 6449 461 1 Fe 11 3 2 1 2 F dxz 2.565 4 -1 0 65 6450 461 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -1 0 66 6451 461 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -1 0 67 6452 461 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -1 0 68 6453 461 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -1 0 69 6454 462 1 Fe 1 4 0 0 1 F s 9.649 4 -1 0 70 6455 462 1 Fe 2 4 0 0 2 F s 6.885 4 -1 0 71 6456 462 1 Fe 3 3 2 -2 1 F dxy 6.632 4 -1 0 72 6457 462 1 Fe 4 3 2 -1 1 F dyz 6.632 4 -1 0 73 6458 462 1 Fe 5 3 2 0 1 F dz2 6.632 4 -1 0 74 6459 462 1 Fe 6 3 2 1 1 F dxz 6.632 4 -1 0 75 6460 462 1 Fe 7 3 2 2 1 F dx2-y2 6.632 4 -1 0 76 6461 462 1 Fe 8 3 2 -2 2 F dxy 2.565 4 -1 0 77 6462 462 1 Fe 9 3 2 -1 2 F dyz 2.565 4 -1 0 78 6463 462 1 Fe 10 3 2 0 2 F dz2 2.565 4 -1 0 79 6464 462 1 Fe 11 3 2 1 2 F dxz 2.565 4 -1 0 80 6465 462 1 Fe 12 3 2 2 2 F dx2-y2 2.565 4 -1 0 81 6466 462 1 Fe 13 4 1 -1 1 T Ppy 9.649 4 -1 0 82 6467 462 1 Fe 14 4 1 0 1 T Ppz 9.649 4 -1 0 83 6468 462 1 Fe 15 4 1 1 1 T Ppx 9.649 4 -1 0 84 6469 463 3 Te 1 5 0 0 1 F s 6.195 -4 -1 0 1 6470 463 3 Te 2 5 0 0 2 F s 4.205 -4 -1 0 2 6471 463 3 Te 3 5 1 -1 1 F py 8.156 -4 -1 0 3 6472 463 3 Te 4 5 1 0 1 F pz 8.156 -4 -1 0 4 6473 463 3 Te 5 5 1 1 1 F px 8.156 -4 -1 0 5 6474 463 3 Te 6 5 1 -1 2 F py 5.009 -4 -1 0 6 6475 463 3 Te 7 5 1 0 2 F pz 5.009 -4 -1 0 7 6476 463 3 Te 8 5 1 1 2 F px 5.009 -4 -1 0 8 6477 463 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -1 0 9 6478 463 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -1 0 10 6479 463 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -1 0 11 6480 463 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -1 0 12 6481 463 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -1 0 13 6482 464 3 Te 1 5 0 0 1 F s 6.195 -4 -1 0 14 6483 464 3 Te 2 5 0 0 2 F s 4.205 -4 -1 0 15 6484 464 3 Te 3 5 1 -1 1 F py 8.156 -4 -1 0 16 6485 464 3 Te 4 5 1 0 1 F pz 8.156 -4 -1 0 17 6486 464 3 Te 5 5 1 1 1 F px 8.156 -4 -1 0 18 6487 464 3 Te 6 5 1 -1 2 F py 5.009 -4 -1 0 19 6488 464 3 Te 7 5 1 0 2 F pz 5.009 -4 -1 0 20 6489 464 3 Te 8 5 1 1 2 F px 5.009 -4 -1 0 21 6490 464 3 Te 9 5 2 -2 1 T Pdxy 8.156 -4 -1 0 22 6491 464 3 Te 10 5 2 -1 1 T Pdyz 8.156 -4 -1 0 23 6492 464 3 Te 11 5 2 0 1 T Pdz2 8.156 -4 -1 0 24 6493 464 3 Te 12 5 2 1 1 T Pdxz 8.156 -4 -1 0 25 6494 464 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -4 -1 0 26 6495 465 2 Ge 1 4 0 0 1 F s 6.581 -4 -1 0 27 6496 465 2 Ge 2 4 0 0 2 F s 4.412 -4 -1 0 28 6497 465 2 Ge 3 4 1 -1 1 F py 9.340 -4 -1 0 29 6498 465 2 Ge 4 4 1 0 1 F pz 9.340 -4 -1 0 30 6499 465 2 Ge 5 4 1 1 1 F px 9.340 -4 -1 0 31 6500 465 2 Ge 6 4 1 -1 2 F py 5.665 -4 -1 0 32 6501 465 2 Ge 7 4 1 0 2 F pz 5.665 -4 -1 0 33 6502 465 2 Ge 8 4 1 1 2 F px 5.665 -4 -1 0 34 6503 465 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -4 -1 0 35 6504 465 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -4 -1 0 36 6505 465 2 Ge 11 4 2 0 1 T Pdz2 9.340 -4 -1 0 37 6506 465 2 Ge 12 4 2 1 1 T Pdxz 9.340 -4 -1 0 38 6507 465 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -4 -1 0 39 6508 466 1 Fe 1 4 0 0 1 F s 9.649 -4 -1 0 40 6509 466 1 Fe 2 4 0 0 2 F s 6.885 -4 -1 0 41 6510 466 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -1 0 42 6511 466 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -1 0 43 6512 466 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -1 0 44 6513 466 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -1 0 45 6514 466 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -1 0 46 6515 466 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -1 0 47 6516 466 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -1 0 48 6517 466 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -1 0 49 6518 466 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -1 0 50 6519 466 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -1 0 51 6520 466 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -1 0 52 6521 466 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -1 0 53 6522 466 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -1 0 54 6523 467 1 Fe 1 4 0 0 1 F s 9.649 -4 -1 0 55 6524 467 1 Fe 2 4 0 0 2 F s 6.885 -4 -1 0 56 6525 467 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -1 0 57 6526 467 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -1 0 58 6527 467 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -1 0 59 6528 467 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -1 0 60 6529 467 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -1 0 61 6530 467 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -1 0 62 6531 467 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -1 0 63 6532 467 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -1 0 64 6533 467 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -1 0 65 6534 467 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -1 0 66 6535 467 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -1 0 67 6536 467 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -1 0 68 6537 467 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -1 0 69 6538 468 1 Fe 1 4 0 0 1 F s 9.649 -4 -1 0 70 6539 468 1 Fe 2 4 0 0 2 F s 6.885 -4 -1 0 71 6540 468 1 Fe 3 3 2 -2 1 F dxy 6.632 -4 -1 0 72 6541 468 1 Fe 4 3 2 -1 1 F dyz 6.632 -4 -1 0 73 6542 468 1 Fe 5 3 2 0 1 F dz2 6.632 -4 -1 0 74 6543 468 1 Fe 6 3 2 1 1 F dxz 6.632 -4 -1 0 75 6544 468 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -4 -1 0 76 6545 468 1 Fe 8 3 2 -2 2 F dxy 2.565 -4 -1 0 77 6546 468 1 Fe 9 3 2 -1 2 F dyz 2.565 -4 -1 0 78 6547 468 1 Fe 10 3 2 0 2 F dz2 2.565 -4 -1 0 79 6548 468 1 Fe 11 3 2 1 2 F dxz 2.565 -4 -1 0 80 6549 468 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -4 -1 0 81 6550 468 1 Fe 13 4 1 -1 1 T Ppy 9.649 -4 -1 0 82 6551 468 1 Fe 14 4 1 0 1 T Ppz 9.649 -4 -1 0 83 6552 468 1 Fe 15 4 1 1 1 T Ppx 9.649 -4 -1 0 84 6553 469 3 Te 1 5 0 0 1 F s 6.195 -3 -1 0 1 6554 469 3 Te 2 5 0 0 2 F s 4.205 -3 -1 0 2 6555 469 3 Te 3 5 1 -1 1 F py 8.156 -3 -1 0 3 6556 469 3 Te 4 5 1 0 1 F pz 8.156 -3 -1 0 4 6557 469 3 Te 5 5 1 1 1 F px 8.156 -3 -1 0 5 6558 469 3 Te 6 5 1 -1 2 F py 5.009 -3 -1 0 6 6559 469 3 Te 7 5 1 0 2 F pz 5.009 -3 -1 0 7 6560 469 3 Te 8 5 1 1 2 F px 5.009 -3 -1 0 8 6561 469 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -1 0 9 6562 469 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -1 0 10 6563 469 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -1 0 11 6564 469 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -1 0 12 6565 469 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -1 0 13 6566 470 3 Te 1 5 0 0 1 F s 6.195 -3 -1 0 14 6567 470 3 Te 2 5 0 0 2 F s 4.205 -3 -1 0 15 6568 470 3 Te 3 5 1 -1 1 F py 8.156 -3 -1 0 16 6569 470 3 Te 4 5 1 0 1 F pz 8.156 -3 -1 0 17 6570 470 3 Te 5 5 1 1 1 F px 8.156 -3 -1 0 18 6571 470 3 Te 6 5 1 -1 2 F py 5.009 -3 -1 0 19 6572 470 3 Te 7 5 1 0 2 F pz 5.009 -3 -1 0 20 6573 470 3 Te 8 5 1 1 2 F px 5.009 -3 -1 0 21 6574 470 3 Te 9 5 2 -2 1 T Pdxy 8.156 -3 -1 0 22 6575 470 3 Te 10 5 2 -1 1 T Pdyz 8.156 -3 -1 0 23 6576 470 3 Te 11 5 2 0 1 T Pdz2 8.156 -3 -1 0 24 6577 470 3 Te 12 5 2 1 1 T Pdxz 8.156 -3 -1 0 25 6578 470 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -3 -1 0 26 6579 471 2 Ge 1 4 0 0 1 F s 6.581 -3 -1 0 27 6580 471 2 Ge 2 4 0 0 2 F s 4.412 -3 -1 0 28 6581 471 2 Ge 3 4 1 -1 1 F py 9.340 -3 -1 0 29 6582 471 2 Ge 4 4 1 0 1 F pz 9.340 -3 -1 0 30 6583 471 2 Ge 5 4 1 1 1 F px 9.340 -3 -1 0 31 6584 471 2 Ge 6 4 1 -1 2 F py 5.665 -3 -1 0 32 6585 471 2 Ge 7 4 1 0 2 F pz 5.665 -3 -1 0 33 6586 471 2 Ge 8 4 1 1 2 F px 5.665 -3 -1 0 34 6587 471 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -3 -1 0 35 6588 471 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -3 -1 0 36 6589 471 2 Ge 11 4 2 0 1 T Pdz2 9.340 -3 -1 0 37 6590 471 2 Ge 12 4 2 1 1 T Pdxz 9.340 -3 -1 0 38 6591 471 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -3 -1 0 39 6592 472 1 Fe 1 4 0 0 1 F s 9.649 -3 -1 0 40 6593 472 1 Fe 2 4 0 0 2 F s 6.885 -3 -1 0 41 6594 472 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -1 0 42 6595 472 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -1 0 43 6596 472 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -1 0 44 6597 472 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -1 0 45 6598 472 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -1 0 46 6599 472 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -1 0 47 6600 472 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -1 0 48 6601 472 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -1 0 49 6602 472 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -1 0 50 6603 472 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -1 0 51 6604 472 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -1 0 52 6605 472 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -1 0 53 6606 472 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -1 0 54 6607 473 1 Fe 1 4 0 0 1 F s 9.649 -3 -1 0 55 6608 473 1 Fe 2 4 0 0 2 F s 6.885 -3 -1 0 56 6609 473 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -1 0 57 6610 473 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -1 0 58 6611 473 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -1 0 59 6612 473 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -1 0 60 6613 473 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -1 0 61 6614 473 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -1 0 62 6615 473 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -1 0 63 6616 473 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -1 0 64 6617 473 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -1 0 65 6618 473 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -1 0 66 6619 473 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -1 0 67 6620 473 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -1 0 68 6621 473 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -1 0 69 6622 474 1 Fe 1 4 0 0 1 F s 9.649 -3 -1 0 70 6623 474 1 Fe 2 4 0 0 2 F s 6.885 -3 -1 0 71 6624 474 1 Fe 3 3 2 -2 1 F dxy 6.632 -3 -1 0 72 6625 474 1 Fe 4 3 2 -1 1 F dyz 6.632 -3 -1 0 73 6626 474 1 Fe 5 3 2 0 1 F dz2 6.632 -3 -1 0 74 6627 474 1 Fe 6 3 2 1 1 F dxz 6.632 -3 -1 0 75 6628 474 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -3 -1 0 76 6629 474 1 Fe 8 3 2 -2 2 F dxy 2.565 -3 -1 0 77 6630 474 1 Fe 9 3 2 -1 2 F dyz 2.565 -3 -1 0 78 6631 474 1 Fe 10 3 2 0 2 F dz2 2.565 -3 -1 0 79 6632 474 1 Fe 11 3 2 1 2 F dxz 2.565 -3 -1 0 80 6633 474 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -3 -1 0 81 6634 474 1 Fe 13 4 1 -1 1 T Ppy 9.649 -3 -1 0 82 6635 474 1 Fe 14 4 1 0 1 T Ppz 9.649 -3 -1 0 83 6636 474 1 Fe 15 4 1 1 1 T Ppx 9.649 -3 -1 0 84 6637 475 3 Te 1 5 0 0 1 F s 6.195 -2 -1 0 1 6638 475 3 Te 2 5 0 0 2 F s 4.205 -2 -1 0 2 6639 475 3 Te 3 5 1 -1 1 F py 8.156 -2 -1 0 3 6640 475 3 Te 4 5 1 0 1 F pz 8.156 -2 -1 0 4 6641 475 3 Te 5 5 1 1 1 F px 8.156 -2 -1 0 5 6642 475 3 Te 6 5 1 -1 2 F py 5.009 -2 -1 0 6 6643 475 3 Te 7 5 1 0 2 F pz 5.009 -2 -1 0 7 6644 475 3 Te 8 5 1 1 2 F px 5.009 -2 -1 0 8 6645 475 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -1 0 9 6646 475 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -1 0 10 6647 475 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -1 0 11 6648 475 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -1 0 12 6649 475 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -1 0 13 6650 476 3 Te 1 5 0 0 1 F s 6.195 -2 -1 0 14 6651 476 3 Te 2 5 0 0 2 F s 4.205 -2 -1 0 15 6652 476 3 Te 3 5 1 -1 1 F py 8.156 -2 -1 0 16 6653 476 3 Te 4 5 1 0 1 F pz 8.156 -2 -1 0 17 6654 476 3 Te 5 5 1 1 1 F px 8.156 -2 -1 0 18 6655 476 3 Te 6 5 1 -1 2 F py 5.009 -2 -1 0 19 6656 476 3 Te 7 5 1 0 2 F pz 5.009 -2 -1 0 20 6657 476 3 Te 8 5 1 1 2 F px 5.009 -2 -1 0 21 6658 476 3 Te 9 5 2 -2 1 T Pdxy 8.156 -2 -1 0 22 6659 476 3 Te 10 5 2 -1 1 T Pdyz 8.156 -2 -1 0 23 6660 476 3 Te 11 5 2 0 1 T Pdz2 8.156 -2 -1 0 24 6661 476 3 Te 12 5 2 1 1 T Pdxz 8.156 -2 -1 0 25 6662 476 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -2 -1 0 26 6663 477 2 Ge 1 4 0 0 1 F s 6.581 -2 -1 0 27 6664 477 2 Ge 2 4 0 0 2 F s 4.412 -2 -1 0 28 6665 477 2 Ge 3 4 1 -1 1 F py 9.340 -2 -1 0 29 6666 477 2 Ge 4 4 1 0 1 F pz 9.340 -2 -1 0 30 6667 477 2 Ge 5 4 1 1 1 F px 9.340 -2 -1 0 31 6668 477 2 Ge 6 4 1 -1 2 F py 5.665 -2 -1 0 32 6669 477 2 Ge 7 4 1 0 2 F pz 5.665 -2 -1 0 33 6670 477 2 Ge 8 4 1 1 2 F px 5.665 -2 -1 0 34 6671 477 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -2 -1 0 35 6672 477 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -2 -1 0 36 6673 477 2 Ge 11 4 2 0 1 T Pdz2 9.340 -2 -1 0 37 6674 477 2 Ge 12 4 2 1 1 T Pdxz 9.340 -2 -1 0 38 6675 477 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -2 -1 0 39 6676 478 1 Fe 1 4 0 0 1 F s 9.649 -2 -1 0 40 6677 478 1 Fe 2 4 0 0 2 F s 6.885 -2 -1 0 41 6678 478 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -1 0 42 6679 478 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -1 0 43 6680 478 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -1 0 44 6681 478 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -1 0 45 6682 478 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -1 0 46 6683 478 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -1 0 47 6684 478 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -1 0 48 6685 478 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -1 0 49 6686 478 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -1 0 50 6687 478 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -1 0 51 6688 478 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -1 0 52 6689 478 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -1 0 53 6690 478 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -1 0 54 6691 479 1 Fe 1 4 0 0 1 F s 9.649 -2 -1 0 55 6692 479 1 Fe 2 4 0 0 2 F s 6.885 -2 -1 0 56 6693 479 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -1 0 57 6694 479 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -1 0 58 6695 479 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -1 0 59 6696 479 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -1 0 60 6697 479 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -1 0 61 6698 479 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -1 0 62 6699 479 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -1 0 63 6700 479 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -1 0 64 6701 479 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -1 0 65 6702 479 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -1 0 66 6703 479 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -1 0 67 6704 479 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -1 0 68 6705 479 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -1 0 69 6706 480 1 Fe 1 4 0 0 1 F s 9.649 -2 -1 0 70 6707 480 1 Fe 2 4 0 0 2 F s 6.885 -2 -1 0 71 6708 480 1 Fe 3 3 2 -2 1 F dxy 6.632 -2 -1 0 72 6709 480 1 Fe 4 3 2 -1 1 F dyz 6.632 -2 -1 0 73 6710 480 1 Fe 5 3 2 0 1 F dz2 6.632 -2 -1 0 74 6711 480 1 Fe 6 3 2 1 1 F dxz 6.632 -2 -1 0 75 6712 480 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -2 -1 0 76 6713 480 1 Fe 8 3 2 -2 2 F dxy 2.565 -2 -1 0 77 6714 480 1 Fe 9 3 2 -1 2 F dyz 2.565 -2 -1 0 78 6715 480 1 Fe 10 3 2 0 2 F dz2 2.565 -2 -1 0 79 6716 480 1 Fe 11 3 2 1 2 F dxz 2.565 -2 -1 0 80 6717 480 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -2 -1 0 81 6718 480 1 Fe 13 4 1 -1 1 T Ppy 9.649 -2 -1 0 82 6719 480 1 Fe 14 4 1 0 1 T Ppz 9.649 -2 -1 0 83 6720 480 1 Fe 15 4 1 1 1 T Ppx 9.649 -2 -1 0 84 6721 481 3 Te 1 5 0 0 1 F s 6.195 -1 -1 0 1 6722 481 3 Te 2 5 0 0 2 F s 4.205 -1 -1 0 2 6723 481 3 Te 3 5 1 -1 1 F py 8.156 -1 -1 0 3 6724 481 3 Te 4 5 1 0 1 F pz 8.156 -1 -1 0 4 6725 481 3 Te 5 5 1 1 1 F px 8.156 -1 -1 0 5 6726 481 3 Te 6 5 1 -1 2 F py 5.009 -1 -1 0 6 6727 481 3 Te 7 5 1 0 2 F pz 5.009 -1 -1 0 7 6728 481 3 Te 8 5 1 1 2 F px 5.009 -1 -1 0 8 6729 481 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -1 0 9 6730 481 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -1 0 10 6731 481 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -1 0 11 6732 481 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -1 0 12 6733 481 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -1 0 13 6734 482 3 Te 1 5 0 0 1 F s 6.195 -1 -1 0 14 6735 482 3 Te 2 5 0 0 2 F s 4.205 -1 -1 0 15 6736 482 3 Te 3 5 1 -1 1 F py 8.156 -1 -1 0 16 6737 482 3 Te 4 5 1 0 1 F pz 8.156 -1 -1 0 17 6738 482 3 Te 5 5 1 1 1 F px 8.156 -1 -1 0 18 6739 482 3 Te 6 5 1 -1 2 F py 5.009 -1 -1 0 19 6740 482 3 Te 7 5 1 0 2 F pz 5.009 -1 -1 0 20 6741 482 3 Te 8 5 1 1 2 F px 5.009 -1 -1 0 21 6742 482 3 Te 9 5 2 -2 1 T Pdxy 8.156 -1 -1 0 22 6743 482 3 Te 10 5 2 -1 1 T Pdyz 8.156 -1 -1 0 23 6744 482 3 Te 11 5 2 0 1 T Pdz2 8.156 -1 -1 0 24 6745 482 3 Te 12 5 2 1 1 T Pdxz 8.156 -1 -1 0 25 6746 482 3 Te 13 5 2 2 1 T Pdx2-y2 8.156 -1 -1 0 26 6747 483 2 Ge 1 4 0 0 1 F s 6.581 -1 -1 0 27 6748 483 2 Ge 2 4 0 0 2 F s 4.412 -1 -1 0 28 6749 483 2 Ge 3 4 1 -1 1 F py 9.340 -1 -1 0 29 6750 483 2 Ge 4 4 1 0 1 F pz 9.340 -1 -1 0 30 6751 483 2 Ge 5 4 1 1 1 F px 9.340 -1 -1 0 31 6752 483 2 Ge 6 4 1 -1 2 F py 5.665 -1 -1 0 32 6753 483 2 Ge 7 4 1 0 2 F pz 5.665 -1 -1 0 33 6754 483 2 Ge 8 4 1 1 2 F px 5.665 -1 -1 0 34 6755 483 2 Ge 9 4 2 -2 1 T Pdxy 9.340 -1 -1 0 35 6756 483 2 Ge 10 4 2 -1 1 T Pdyz 9.340 -1 -1 0 36 6757 483 2 Ge 11 4 2 0 1 T Pdz2 9.340 -1 -1 0 37 6758 483 2 Ge 12 4 2 1 1 T Pdxz 9.340 -1 -1 0 38 6759 483 2 Ge 13 4 2 2 1 T Pdx2-y2 9.340 -1 -1 0 39 6760 484 1 Fe 1 4 0 0 1 F s 9.649 -1 -1 0 40 6761 484 1 Fe 2 4 0 0 2 F s 6.885 -1 -1 0 41 6762 484 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -1 0 42 6763 484 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -1 0 43 6764 484 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -1 0 44 6765 484 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -1 0 45 6766 484 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -1 0 46 6767 484 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -1 0 47 6768 484 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -1 0 48 6769 484 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -1 0 49 6770 484 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -1 0 50 6771 484 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -1 0 51 6772 484 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -1 0 52 6773 484 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -1 0 53 6774 484 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -1 0 54 6775 485 1 Fe 1 4 0 0 1 F s 9.649 -1 -1 0 55 6776 485 1 Fe 2 4 0 0 2 F s 6.885 -1 -1 0 56 6777 485 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -1 0 57 6778 485 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -1 0 58 6779 485 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -1 0 59 6780 485 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -1 0 60 6781 485 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -1 0 61 6782 485 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -1 0 62 6783 485 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -1 0 63 6784 485 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -1 0 64 6785 485 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -1 0 65 6786 485 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -1 0 66 6787 485 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -1 0 67 6788 485 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -1 0 68 6789 485 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -1 0 69 6790 486 1 Fe 1 4 0 0 1 F s 9.649 -1 -1 0 70 6791 486 1 Fe 2 4 0 0 2 F s 6.885 -1 -1 0 71 6792 486 1 Fe 3 3 2 -2 1 F dxy 6.632 -1 -1 0 72 6793 486 1 Fe 4 3 2 -1 1 F dyz 6.632 -1 -1 0 73 6794 486 1 Fe 5 3 2 0 1 F dz2 6.632 -1 -1 0 74 6795 486 1 Fe 6 3 2 1 1 F dxz 6.632 -1 -1 0 75 6796 486 1 Fe 7 3 2 2 1 F dx2-y2 6.632 -1 -1 0 76 6797 486 1 Fe 8 3 2 -2 2 F dxy 2.565 -1 -1 0 77 6798 486 1 Fe 9 3 2 -1 2 F dyz 2.565 -1 -1 0 78 6799 486 1 Fe 10 3 2 0 2 F dz2 2.565 -1 -1 0 79 6800 486 1 Fe 11 3 2 1 2 F dxz 2.565 -1 -1 0 80 6801 486 1 Fe 12 3 2 2 2 F dx2-y2 2.565 -1 -1 0 81 6802 486 1 Fe 13 4 1 -1 1 T Ppy 9.649 -1 -1 0 82 6803 486 1 Fe 14 4 1 0 1 T Ppz 9.649 -1 -1 0 83 6804 486 1 Fe 15 4 1 1 1 T Ppx 9.649 -1 -1 0 84 Column codes: io = Orbital index in supercell ia = Atom to which orbital belongs is = Atomic species index spec = Atomic species label iao = Orbital index within atom n = Principal quantum number l = Angular mumentum quantum number m = Magnetic quantum number of (real) orbital: m<0 => sin(m*phi), m>=0 => cos(m*phi) z = Zeta index of orbital p = Is this a polarization orbital? (False|True) sym = Symmetry name of real orbital rc = Cutoff radius of orbital (Bohr) isc = Unit cell indexes to which orbital belongs: center(io) = center(iuo) + sum_(i=1:3) cell_vec(i) * isc(i) iuo = Equivalent orbital in first unit cell