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grogu/Jij_for_Marci_6p45ang/CrBr3.ORB_INDX

5314 lines
404 KiB
Raw Blame History

108 5292 = 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 1 Cr 1 4 0 0 1 F s 9.697 0 0 0 1
2 1 1 Cr 2 4 0 0 2 F s 8.001 0 0 0 2
3 1 1 Cr 3 4 1 -1 1 F py 14.099 0 0 0 3
4 1 1 Cr 4 4 1 0 1 F pz 14.099 0 0 0 4
5 1 1 Cr 5 4 1 1 1 F px 14.099 0 0 0 5
6 1 1 Cr 6 3 2 -2 1 F dxy 7.210 0 0 0 6
7 1 1 Cr 7 3 2 -1 1 F dyz 7.210 0 0 0 7
8 1 1 Cr 8 3 2 0 1 F dz2 7.210 0 0 0 8
9 1 1 Cr 9 3 2 1 1 F dxz 7.210 0 0 0 9
10 1 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 0 0 10
11 1 1 Cr 11 3 2 -2 2 F dxy 3.913 0 0 0 11
12 1 1 Cr 12 3 2 -1 2 F dyz 3.913 0 0 0 12
13 1 1 Cr 13 3 2 0 2 F dz2 3.913 0 0 0 13
14 1 1 Cr 14 3 2 1 2 F dxz 3.913 0 0 0 14
15 1 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 0 0 15
16 2 1 Cr 1 4 0 0 1 F s 9.697 0 0 0 16
17 2 1 Cr 2 4 0 0 2 F s 8.001 0 0 0 17
18 2 1 Cr 3 4 1 -1 1 F py 14.099 0 0 0 18
19 2 1 Cr 4 4 1 0 1 F pz 14.099 0 0 0 19
20 2 1 Cr 5 4 1 1 1 F px 14.099 0 0 0 20
21 2 1 Cr 6 3 2 -2 1 F dxy 7.210 0 0 0 21
22 2 1 Cr 7 3 2 -1 1 F dyz 7.210 0 0 0 22
23 2 1 Cr 8 3 2 0 1 F dz2 7.210 0 0 0 23
24 2 1 Cr 9 3 2 1 1 F dxz 7.210 0 0 0 24
25 2 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 0 0 25
26 2 1 Cr 11 3 2 -2 2 F dxy 3.913 0 0 0 26
27 2 1 Cr 12 3 2 -1 2 F dyz 3.913 0 0 0 27
28 2 1 Cr 13 3 2 0 2 F dz2 3.913 0 0 0 28
29 2 1 Cr 14 3 2 1 2 F dxz 3.913 0 0 0 29
30 2 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 0 0 30
31 3 2 Br 1 4 0 0 1 F s 5.317 0 0 0 31
32 3 2 Br 2 4 0 0 2 F s 3.476 0 0 0 32
33 3 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 33
34 3 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 34
35 3 2 Br 5 4 1 1 1 F px 6.996 0 0 0 35
36 3 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 36
37 3 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 37
38 3 2 Br 8 4 1 1 2 F px 4.032 0 0 0 38
39 3 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 39
40 3 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 40
41 3 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 41
42 3 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 42
43 3 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 43
44 4 2 Br 1 4 0 0 1 F s 5.317 0 0 0 44
45 4 2 Br 2 4 0 0 2 F s 3.476 0 0 0 45
46 4 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 46
47 4 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 47
48 4 2 Br 5 4 1 1 1 F px 6.996 0 0 0 48
49 4 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 49
50 4 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 50
51 4 2 Br 8 4 1 1 2 F px 4.032 0 0 0 51
52 4 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 52
53 4 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 53
54 4 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 54
55 4 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 55
56 4 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 56
57 5 2 Br 1 4 0 0 1 F s 5.317 0 0 0 57
58 5 2 Br 2 4 0 0 2 F s 3.476 0 0 0 58
59 5 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 59
60 5 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 60
61 5 2 Br 5 4 1 1 1 F px 6.996 0 0 0 61
62 5 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 62
63 5 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 63
64 5 2 Br 8 4 1 1 2 F px 4.032 0 0 0 64
65 5 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 65
66 5 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 66
67 5 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 67
68 5 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 68
69 5 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 69
70 6 2 Br 1 4 0 0 1 F s 5.317 0 0 0 70
71 6 2 Br 2 4 0 0 2 F s 3.476 0 0 0 71
72 6 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 72
73 6 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 73
74 6 2 Br 5 4 1 1 1 F px 6.996 0 0 0 74
75 6 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 75
76 6 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 76
77 6 2 Br 8 4 1 1 2 F px 4.032 0 0 0 77
78 6 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 78
79 6 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 79
80 6 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 80
81 6 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 81
82 6 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 82
83 7 2 Br 1 4 0 0 1 F s 5.317 0 0 0 83
84 7 2 Br 2 4 0 0 2 F s 3.476 0 0 0 84
85 7 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 85
86 7 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 86
87 7 2 Br 5 4 1 1 1 F px 6.996 0 0 0 87
88 7 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 88
89 7 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 89
90 7 2 Br 8 4 1 1 2 F px 4.032 0 0 0 90
91 7 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 91
92 7 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 92
93 7 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 93
94 7 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 94
95 7 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 95
96 8 2 Br 1 4 0 0 1 F s 5.317 0 0 0 96
97 8 2 Br 2 4 0 0 2 F s 3.476 0 0 0 97
98 8 2 Br 3 4 1 -1 1 F py 6.996 0 0 0 98
99 8 2 Br 4 4 1 0 1 F pz 6.996 0 0 0 99
100 8 2 Br 5 4 1 1 1 F px 6.996 0 0 0 100
101 8 2 Br 6 4 1 -1 2 F py 4.032 0 0 0 101
102 8 2 Br 7 4 1 0 2 F pz 4.032 0 0 0 102
103 8 2 Br 8 4 1 1 2 F px 4.032 0 0 0 103
104 8 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 0 0 104
105 8 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 0 0 105
106 8 2 Br 11 4 2 0 1 T Pdz2 6.996 0 0 0 106
107 8 2 Br 12 4 2 1 1 T Pdxz 6.996 0 0 0 107
108 8 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 0 0 108
109 9 1 Cr 1 4 0 0 1 F s 9.697 1 0 0 1
110 9 1 Cr 2 4 0 0 2 F s 8.001 1 0 0 2
111 9 1 Cr 3 4 1 -1 1 F py 14.099 1 0 0 3
112 9 1 Cr 4 4 1 0 1 F pz 14.099 1 0 0 4
113 9 1 Cr 5 4 1 1 1 F px 14.099 1 0 0 5
114 9 1 Cr 6 3 2 -2 1 F dxy 7.210 1 0 0 6
115 9 1 Cr 7 3 2 -1 1 F dyz 7.210 1 0 0 7
116 9 1 Cr 8 3 2 0 1 F dz2 7.210 1 0 0 8
117 9 1 Cr 9 3 2 1 1 F dxz 7.210 1 0 0 9
118 9 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 0 0 10
119 9 1 Cr 11 3 2 -2 2 F dxy 3.913 1 0 0 11
120 9 1 Cr 12 3 2 -1 2 F dyz 3.913 1 0 0 12
121 9 1 Cr 13 3 2 0 2 F dz2 3.913 1 0 0 13
122 9 1 Cr 14 3 2 1 2 F dxz 3.913 1 0 0 14
123 9 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 0 0 15
124 10 1 Cr 1 4 0 0 1 F s 9.697 1 0 0 16
125 10 1 Cr 2 4 0 0 2 F s 8.001 1 0 0 17
126 10 1 Cr 3 4 1 -1 1 F py 14.099 1 0 0 18
127 10 1 Cr 4 4 1 0 1 F pz 14.099 1 0 0 19
128 10 1 Cr 5 4 1 1 1 F px 14.099 1 0 0 20
129 10 1 Cr 6 3 2 -2 1 F dxy 7.210 1 0 0 21
130 10 1 Cr 7 3 2 -1 1 F dyz 7.210 1 0 0 22
131 10 1 Cr 8 3 2 0 1 F dz2 7.210 1 0 0 23
132 10 1 Cr 9 3 2 1 1 F dxz 7.210 1 0 0 24
133 10 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 0 0 25
134 10 1 Cr 11 3 2 -2 2 F dxy 3.913 1 0 0 26
135 10 1 Cr 12 3 2 -1 2 F dyz 3.913 1 0 0 27
136 10 1 Cr 13 3 2 0 2 F dz2 3.913 1 0 0 28
137 10 1 Cr 14 3 2 1 2 F dxz 3.913 1 0 0 29
138 10 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 0 0 30
139 11 2 Br 1 4 0 0 1 F s 5.317 1 0 0 31
140 11 2 Br 2 4 0 0 2 F s 3.476 1 0 0 32
141 11 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 33
142 11 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 34
143 11 2 Br 5 4 1 1 1 F px 6.996 1 0 0 35
144 11 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 36
145 11 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 37
146 11 2 Br 8 4 1 1 2 F px 4.032 1 0 0 38
147 11 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 39
148 11 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 40
149 11 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 41
150 11 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 42
151 11 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 43
152 12 2 Br 1 4 0 0 1 F s 5.317 1 0 0 44
153 12 2 Br 2 4 0 0 2 F s 3.476 1 0 0 45
154 12 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 46
155 12 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 47
156 12 2 Br 5 4 1 1 1 F px 6.996 1 0 0 48
157 12 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 49
158 12 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 50
159 12 2 Br 8 4 1 1 2 F px 4.032 1 0 0 51
160 12 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 52
161 12 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 53
162 12 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 54
163 12 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 55
164 12 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 56
165 13 2 Br 1 4 0 0 1 F s 5.317 1 0 0 57
166 13 2 Br 2 4 0 0 2 F s 3.476 1 0 0 58
167 13 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 59
168 13 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 60
169 13 2 Br 5 4 1 1 1 F px 6.996 1 0 0 61
170 13 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 62
171 13 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 63
172 13 2 Br 8 4 1 1 2 F px 4.032 1 0 0 64
173 13 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 65
174 13 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 66
175 13 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 67
176 13 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 68
177 13 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 69
178 14 2 Br 1 4 0 0 1 F s 5.317 1 0 0 70
179 14 2 Br 2 4 0 0 2 F s 3.476 1 0 0 71
180 14 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 72
181 14 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 73
182 14 2 Br 5 4 1 1 1 F px 6.996 1 0 0 74
183 14 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 75
184 14 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 76
185 14 2 Br 8 4 1 1 2 F px 4.032 1 0 0 77
186 14 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 78
187 14 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 79
188 14 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 80
189 14 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 81
190 14 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 82
191 15 2 Br 1 4 0 0 1 F s 5.317 1 0 0 83
192 15 2 Br 2 4 0 0 2 F s 3.476 1 0 0 84
193 15 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 85
194 15 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 86
195 15 2 Br 5 4 1 1 1 F px 6.996 1 0 0 87
196 15 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 88
197 15 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 89
198 15 2 Br 8 4 1 1 2 F px 4.032 1 0 0 90
199 15 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 91
200 15 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 92
201 15 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 93
202 15 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 94
203 15 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 95
204 16 2 Br 1 4 0 0 1 F s 5.317 1 0 0 96
205 16 2 Br 2 4 0 0 2 F s 3.476 1 0 0 97
206 16 2 Br 3 4 1 -1 1 F py 6.996 1 0 0 98
207 16 2 Br 4 4 1 0 1 F pz 6.996 1 0 0 99
208 16 2 Br 5 4 1 1 1 F px 6.996 1 0 0 100
209 16 2 Br 6 4 1 -1 2 F py 4.032 1 0 0 101
210 16 2 Br 7 4 1 0 2 F pz 4.032 1 0 0 102
211 16 2 Br 8 4 1 1 2 F px 4.032 1 0 0 103
212 16 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 0 0 104
213 16 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 0 0 105
214 16 2 Br 11 4 2 0 1 T Pdz2 6.996 1 0 0 106
215 16 2 Br 12 4 2 1 1 T Pdxz 6.996 1 0 0 107
216 16 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 0 0 108
217 17 1 Cr 1 4 0 0 1 F s 9.697 2 0 0 1
218 17 1 Cr 2 4 0 0 2 F s 8.001 2 0 0 2
219 17 1 Cr 3 4 1 -1 1 F py 14.099 2 0 0 3
220 17 1 Cr 4 4 1 0 1 F pz 14.099 2 0 0 4
221 17 1 Cr 5 4 1 1 1 F px 14.099 2 0 0 5
222 17 1 Cr 6 3 2 -2 1 F dxy 7.210 2 0 0 6
223 17 1 Cr 7 3 2 -1 1 F dyz 7.210 2 0 0 7
224 17 1 Cr 8 3 2 0 1 F dz2 7.210 2 0 0 8
225 17 1 Cr 9 3 2 1 1 F dxz 7.210 2 0 0 9
226 17 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 0 0 10
227 17 1 Cr 11 3 2 -2 2 F dxy 3.913 2 0 0 11
228 17 1 Cr 12 3 2 -1 2 F dyz 3.913 2 0 0 12
229 17 1 Cr 13 3 2 0 2 F dz2 3.913 2 0 0 13
230 17 1 Cr 14 3 2 1 2 F dxz 3.913 2 0 0 14
231 17 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 0 0 15
232 18 1 Cr 1 4 0 0 1 F s 9.697 2 0 0 16
233 18 1 Cr 2 4 0 0 2 F s 8.001 2 0 0 17
234 18 1 Cr 3 4 1 -1 1 F py 14.099 2 0 0 18
235 18 1 Cr 4 4 1 0 1 F pz 14.099 2 0 0 19
236 18 1 Cr 5 4 1 1 1 F px 14.099 2 0 0 20
237 18 1 Cr 6 3 2 -2 1 F dxy 7.210 2 0 0 21
238 18 1 Cr 7 3 2 -1 1 F dyz 7.210 2 0 0 22
239 18 1 Cr 8 3 2 0 1 F dz2 7.210 2 0 0 23
240 18 1 Cr 9 3 2 1 1 F dxz 7.210 2 0 0 24
241 18 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 0 0 25
242 18 1 Cr 11 3 2 -2 2 F dxy 3.913 2 0 0 26
243 18 1 Cr 12 3 2 -1 2 F dyz 3.913 2 0 0 27
244 18 1 Cr 13 3 2 0 2 F dz2 3.913 2 0 0 28
245 18 1 Cr 14 3 2 1 2 F dxz 3.913 2 0 0 29
246 18 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 0 0 30
247 19 2 Br 1 4 0 0 1 F s 5.317 2 0 0 31
248 19 2 Br 2 4 0 0 2 F s 3.476 2 0 0 32
249 19 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 33
250 19 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 34
251 19 2 Br 5 4 1 1 1 F px 6.996 2 0 0 35
252 19 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 36
253 19 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 37
254 19 2 Br 8 4 1 1 2 F px 4.032 2 0 0 38
255 19 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 39
256 19 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 40
257 19 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 41
258 19 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 42
259 19 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 43
260 20 2 Br 1 4 0 0 1 F s 5.317 2 0 0 44
261 20 2 Br 2 4 0 0 2 F s 3.476 2 0 0 45
262 20 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 46
263 20 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 47
264 20 2 Br 5 4 1 1 1 F px 6.996 2 0 0 48
265 20 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 49
266 20 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 50
267 20 2 Br 8 4 1 1 2 F px 4.032 2 0 0 51
268 20 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 52
269 20 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 53
270 20 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 54
271 20 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 55
272 20 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 56
273 21 2 Br 1 4 0 0 1 F s 5.317 2 0 0 57
274 21 2 Br 2 4 0 0 2 F s 3.476 2 0 0 58
275 21 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 59
276 21 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 60
277 21 2 Br 5 4 1 1 1 F px 6.996 2 0 0 61
278 21 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 62
279 21 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 63
280 21 2 Br 8 4 1 1 2 F px 4.032 2 0 0 64
281 21 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 65
282 21 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 66
283 21 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 67
284 21 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 68
285 21 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 69
286 22 2 Br 1 4 0 0 1 F s 5.317 2 0 0 70
287 22 2 Br 2 4 0 0 2 F s 3.476 2 0 0 71
288 22 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 72
289 22 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 73
290 22 2 Br 5 4 1 1 1 F px 6.996 2 0 0 74
291 22 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 75
292 22 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 76
293 22 2 Br 8 4 1 1 2 F px 4.032 2 0 0 77
294 22 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 78
295 22 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 79
296 22 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 80
297 22 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 81
298 22 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 82
299 23 2 Br 1 4 0 0 1 F s 5.317 2 0 0 83
300 23 2 Br 2 4 0 0 2 F s 3.476 2 0 0 84
301 23 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 85
302 23 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 86
303 23 2 Br 5 4 1 1 1 F px 6.996 2 0 0 87
304 23 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 88
305 23 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 89
306 23 2 Br 8 4 1 1 2 F px 4.032 2 0 0 90
307 23 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 91
308 23 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 92
309 23 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 93
310 23 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 94
311 23 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 95
312 24 2 Br 1 4 0 0 1 F s 5.317 2 0 0 96
313 24 2 Br 2 4 0 0 2 F s 3.476 2 0 0 97
314 24 2 Br 3 4 1 -1 1 F py 6.996 2 0 0 98
315 24 2 Br 4 4 1 0 1 F pz 6.996 2 0 0 99
316 24 2 Br 5 4 1 1 1 F px 6.996 2 0 0 100
317 24 2 Br 6 4 1 -1 2 F py 4.032 2 0 0 101
318 24 2 Br 7 4 1 0 2 F pz 4.032 2 0 0 102
319 24 2 Br 8 4 1 1 2 F px 4.032 2 0 0 103
320 24 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 0 0 104
321 24 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 0 0 105
322 24 2 Br 11 4 2 0 1 T Pdz2 6.996 2 0 0 106
323 24 2 Br 12 4 2 1 1 T Pdxz 6.996 2 0 0 107
324 24 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 0 0 108
325 25 1 Cr 1 4 0 0 1 F s 9.697 3 0 0 1
326 25 1 Cr 2 4 0 0 2 F s 8.001 3 0 0 2
327 25 1 Cr 3 4 1 -1 1 F py 14.099 3 0 0 3
328 25 1 Cr 4 4 1 0 1 F pz 14.099 3 0 0 4
329 25 1 Cr 5 4 1 1 1 F px 14.099 3 0 0 5
330 25 1 Cr 6 3 2 -2 1 F dxy 7.210 3 0 0 6
331 25 1 Cr 7 3 2 -1 1 F dyz 7.210 3 0 0 7
332 25 1 Cr 8 3 2 0 1 F dz2 7.210 3 0 0 8
333 25 1 Cr 9 3 2 1 1 F dxz 7.210 3 0 0 9
334 25 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 0 0 10
335 25 1 Cr 11 3 2 -2 2 F dxy 3.913 3 0 0 11
336 25 1 Cr 12 3 2 -1 2 F dyz 3.913 3 0 0 12
337 25 1 Cr 13 3 2 0 2 F dz2 3.913 3 0 0 13
338 25 1 Cr 14 3 2 1 2 F dxz 3.913 3 0 0 14
339 25 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 0 0 15
340 26 1 Cr 1 4 0 0 1 F s 9.697 3 0 0 16
341 26 1 Cr 2 4 0 0 2 F s 8.001 3 0 0 17
342 26 1 Cr 3 4 1 -1 1 F py 14.099 3 0 0 18
343 26 1 Cr 4 4 1 0 1 F pz 14.099 3 0 0 19
344 26 1 Cr 5 4 1 1 1 F px 14.099 3 0 0 20
345 26 1 Cr 6 3 2 -2 1 F dxy 7.210 3 0 0 21
346 26 1 Cr 7 3 2 -1 1 F dyz 7.210 3 0 0 22
347 26 1 Cr 8 3 2 0 1 F dz2 7.210 3 0 0 23
348 26 1 Cr 9 3 2 1 1 F dxz 7.210 3 0 0 24
349 26 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 0 0 25
350 26 1 Cr 11 3 2 -2 2 F dxy 3.913 3 0 0 26
351 26 1 Cr 12 3 2 -1 2 F dyz 3.913 3 0 0 27
352 26 1 Cr 13 3 2 0 2 F dz2 3.913 3 0 0 28
353 26 1 Cr 14 3 2 1 2 F dxz 3.913 3 0 0 29
354 26 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 0 0 30
355 27 2 Br 1 4 0 0 1 F s 5.317 3 0 0 31
356 27 2 Br 2 4 0 0 2 F s 3.476 3 0 0 32
357 27 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 33
358 27 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 34
359 27 2 Br 5 4 1 1 1 F px 6.996 3 0 0 35
360 27 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 36
361 27 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 37
362 27 2 Br 8 4 1 1 2 F px 4.032 3 0 0 38
363 27 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 39
364 27 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 40
365 27 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 41
366 27 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 42
367 27 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 43
368 28 2 Br 1 4 0 0 1 F s 5.317 3 0 0 44
369 28 2 Br 2 4 0 0 2 F s 3.476 3 0 0 45
370 28 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 46
371 28 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 47
372 28 2 Br 5 4 1 1 1 F px 6.996 3 0 0 48
373 28 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 49
374 28 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 50
375 28 2 Br 8 4 1 1 2 F px 4.032 3 0 0 51
376 28 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 52
377 28 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 53
378 28 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 54
379 28 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 55
380 28 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 56
381 29 2 Br 1 4 0 0 1 F s 5.317 3 0 0 57
382 29 2 Br 2 4 0 0 2 F s 3.476 3 0 0 58
383 29 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 59
384 29 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 60
385 29 2 Br 5 4 1 1 1 F px 6.996 3 0 0 61
386 29 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 62
387 29 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 63
388 29 2 Br 8 4 1 1 2 F px 4.032 3 0 0 64
389 29 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 65
390 29 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 66
391 29 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 67
392 29 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 68
393 29 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 69
394 30 2 Br 1 4 0 0 1 F s 5.317 3 0 0 70
395 30 2 Br 2 4 0 0 2 F s 3.476 3 0 0 71
396 30 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 72
397 30 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 73
398 30 2 Br 5 4 1 1 1 F px 6.996 3 0 0 74
399 30 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 75
400 30 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 76
401 30 2 Br 8 4 1 1 2 F px 4.032 3 0 0 77
402 30 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 78
403 30 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 79
404 30 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 80
405 30 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 81
406 30 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 82
407 31 2 Br 1 4 0 0 1 F s 5.317 3 0 0 83
408 31 2 Br 2 4 0 0 2 F s 3.476 3 0 0 84
409 31 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 85
410 31 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 86
411 31 2 Br 5 4 1 1 1 F px 6.996 3 0 0 87
412 31 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 88
413 31 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 89
414 31 2 Br 8 4 1 1 2 F px 4.032 3 0 0 90
415 31 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 91
416 31 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 92
417 31 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 93
418 31 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 94
419 31 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 95
420 32 2 Br 1 4 0 0 1 F s 5.317 3 0 0 96
421 32 2 Br 2 4 0 0 2 F s 3.476 3 0 0 97
422 32 2 Br 3 4 1 -1 1 F py 6.996 3 0 0 98
423 32 2 Br 4 4 1 0 1 F pz 6.996 3 0 0 99
424 32 2 Br 5 4 1 1 1 F px 6.996 3 0 0 100
425 32 2 Br 6 4 1 -1 2 F py 4.032 3 0 0 101
426 32 2 Br 7 4 1 0 2 F pz 4.032 3 0 0 102
427 32 2 Br 8 4 1 1 2 F px 4.032 3 0 0 103
428 32 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 0 0 104
429 32 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 0 0 105
430 32 2 Br 11 4 2 0 1 T Pdz2 6.996 3 0 0 106
431 32 2 Br 12 4 2 1 1 T Pdxz 6.996 3 0 0 107
432 32 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 0 0 108
433 33 1 Cr 1 4 0 0 1 F s 9.697 -3 0 0 1
434 33 1 Cr 2 4 0 0 2 F s 8.001 -3 0 0 2
435 33 1 Cr 3 4 1 -1 1 F py 14.099 -3 0 0 3
436 33 1 Cr 4 4 1 0 1 F pz 14.099 -3 0 0 4
437 33 1 Cr 5 4 1 1 1 F px 14.099 -3 0 0 5
438 33 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 0 0 6
439 33 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 0 0 7
440 33 1 Cr 8 3 2 0 1 F dz2 7.210 -3 0 0 8
441 33 1 Cr 9 3 2 1 1 F dxz 7.210 -3 0 0 9
442 33 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 0 0 10
443 33 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 0 0 11
444 33 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 0 0 12
445 33 1 Cr 13 3 2 0 2 F dz2 3.913 -3 0 0 13
446 33 1 Cr 14 3 2 1 2 F dxz 3.913 -3 0 0 14
447 33 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 0 0 15
448 34 1 Cr 1 4 0 0 1 F s 9.697 -3 0 0 16
449 34 1 Cr 2 4 0 0 2 F s 8.001 -3 0 0 17
450 34 1 Cr 3 4 1 -1 1 F py 14.099 -3 0 0 18
451 34 1 Cr 4 4 1 0 1 F pz 14.099 -3 0 0 19
452 34 1 Cr 5 4 1 1 1 F px 14.099 -3 0 0 20
453 34 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 0 0 21
454 34 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 0 0 22
455 34 1 Cr 8 3 2 0 1 F dz2 7.210 -3 0 0 23
456 34 1 Cr 9 3 2 1 1 F dxz 7.210 -3 0 0 24
457 34 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 0 0 25
458 34 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 0 0 26
459 34 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 0 0 27
460 34 1 Cr 13 3 2 0 2 F dz2 3.913 -3 0 0 28
461 34 1 Cr 14 3 2 1 2 F dxz 3.913 -3 0 0 29
462 34 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 0 0 30
463 35 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 31
464 35 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 32
465 35 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 33
466 35 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 34
467 35 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 35
468 35 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 36
469 35 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 37
470 35 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 38
471 35 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 39
472 35 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 40
473 35 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 41
474 35 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 42
475 35 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 43
476 36 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 44
477 36 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 45
478 36 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 46
479 36 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 47
480 36 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 48
481 36 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 49
482 36 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 50
483 36 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 51
484 36 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 52
485 36 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 53
486 36 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 54
487 36 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 55
488 36 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 56
489 37 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 57
490 37 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 58
491 37 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 59
492 37 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 60
493 37 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 61
494 37 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 62
495 37 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 63
496 37 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 64
497 37 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 65
498 37 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 66
499 37 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 67
500 37 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 68
501 37 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 69
502 38 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 70
503 38 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 71
504 38 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 72
505 38 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 73
506 38 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 74
507 38 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 75
508 38 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 76
509 38 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 77
510 38 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 78
511 38 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 79
512 38 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 80
513 38 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 81
514 38 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 82
515 39 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 83
516 39 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 84
517 39 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 85
518 39 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 86
519 39 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 87
520 39 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 88
521 39 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 89
522 39 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 90
523 39 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 91
524 39 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 92
525 39 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 93
526 39 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 94
527 39 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 95
528 40 2 Br 1 4 0 0 1 F s 5.317 -3 0 0 96
529 40 2 Br 2 4 0 0 2 F s 3.476 -3 0 0 97
530 40 2 Br 3 4 1 -1 1 F py 6.996 -3 0 0 98
531 40 2 Br 4 4 1 0 1 F pz 6.996 -3 0 0 99
532 40 2 Br 5 4 1 1 1 F px 6.996 -3 0 0 100
533 40 2 Br 6 4 1 -1 2 F py 4.032 -3 0 0 101
534 40 2 Br 7 4 1 0 2 F pz 4.032 -3 0 0 102
535 40 2 Br 8 4 1 1 2 F px 4.032 -3 0 0 103
536 40 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 0 0 104
537 40 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 0 0 105
538 40 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 0 0 106
539 40 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 0 0 107
540 40 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 0 0 108
541 41 1 Cr 1 4 0 0 1 F s 9.697 -2 0 0 1
542 41 1 Cr 2 4 0 0 2 F s 8.001 -2 0 0 2
543 41 1 Cr 3 4 1 -1 1 F py 14.099 -2 0 0 3
544 41 1 Cr 4 4 1 0 1 F pz 14.099 -2 0 0 4
545 41 1 Cr 5 4 1 1 1 F px 14.099 -2 0 0 5
546 41 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 0 0 6
547 41 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 0 0 7
548 41 1 Cr 8 3 2 0 1 F dz2 7.210 -2 0 0 8
549 41 1 Cr 9 3 2 1 1 F dxz 7.210 -2 0 0 9
550 41 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 0 0 10
551 41 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 0 0 11
552 41 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 0 0 12
553 41 1 Cr 13 3 2 0 2 F dz2 3.913 -2 0 0 13
554 41 1 Cr 14 3 2 1 2 F dxz 3.913 -2 0 0 14
555 41 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 0 0 15
556 42 1 Cr 1 4 0 0 1 F s 9.697 -2 0 0 16
557 42 1 Cr 2 4 0 0 2 F s 8.001 -2 0 0 17
558 42 1 Cr 3 4 1 -1 1 F py 14.099 -2 0 0 18
559 42 1 Cr 4 4 1 0 1 F pz 14.099 -2 0 0 19
560 42 1 Cr 5 4 1 1 1 F px 14.099 -2 0 0 20
561 42 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 0 0 21
562 42 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 0 0 22
563 42 1 Cr 8 3 2 0 1 F dz2 7.210 -2 0 0 23
564 42 1 Cr 9 3 2 1 1 F dxz 7.210 -2 0 0 24
565 42 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 0 0 25
566 42 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 0 0 26
567 42 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 0 0 27
568 42 1 Cr 13 3 2 0 2 F dz2 3.913 -2 0 0 28
569 42 1 Cr 14 3 2 1 2 F dxz 3.913 -2 0 0 29
570 42 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 0 0 30
571 43 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 31
572 43 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 32
573 43 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 33
574 43 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 34
575 43 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 35
576 43 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 36
577 43 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 37
578 43 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 38
579 43 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 39
580 43 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 40
581 43 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 41
582 43 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 42
583 43 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 43
584 44 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 44
585 44 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 45
586 44 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 46
587 44 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 47
588 44 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 48
589 44 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 49
590 44 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 50
591 44 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 51
592 44 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 52
593 44 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 53
594 44 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 54
595 44 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 55
596 44 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 56
597 45 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 57
598 45 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 58
599 45 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 59
600 45 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 60
601 45 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 61
602 45 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 62
603 45 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 63
604 45 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 64
605 45 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 65
606 45 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 66
607 45 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 67
608 45 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 68
609 45 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 69
610 46 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 70
611 46 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 71
612 46 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 72
613 46 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 73
614 46 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 74
615 46 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 75
616 46 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 76
617 46 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 77
618 46 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 78
619 46 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 79
620 46 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 80
621 46 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 81
622 46 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 82
623 47 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 83
624 47 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 84
625 47 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 85
626 47 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 86
627 47 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 87
628 47 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 88
629 47 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 89
630 47 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 90
631 47 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 91
632 47 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 92
633 47 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 93
634 47 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 94
635 47 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 95
636 48 2 Br 1 4 0 0 1 F s 5.317 -2 0 0 96
637 48 2 Br 2 4 0 0 2 F s 3.476 -2 0 0 97
638 48 2 Br 3 4 1 -1 1 F py 6.996 -2 0 0 98
639 48 2 Br 4 4 1 0 1 F pz 6.996 -2 0 0 99
640 48 2 Br 5 4 1 1 1 F px 6.996 -2 0 0 100
641 48 2 Br 6 4 1 -1 2 F py 4.032 -2 0 0 101
642 48 2 Br 7 4 1 0 2 F pz 4.032 -2 0 0 102
643 48 2 Br 8 4 1 1 2 F px 4.032 -2 0 0 103
644 48 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 0 0 104
645 48 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 0 0 105
646 48 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 0 0 106
647 48 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 0 0 107
648 48 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 0 0 108
649 49 1 Cr 1 4 0 0 1 F s 9.697 -1 0 0 1
650 49 1 Cr 2 4 0 0 2 F s 8.001 -1 0 0 2
651 49 1 Cr 3 4 1 -1 1 F py 14.099 -1 0 0 3
652 49 1 Cr 4 4 1 0 1 F pz 14.099 -1 0 0 4
653 49 1 Cr 5 4 1 1 1 F px 14.099 -1 0 0 5
654 49 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 0 0 6
655 49 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 0 0 7
656 49 1 Cr 8 3 2 0 1 F dz2 7.210 -1 0 0 8
657 49 1 Cr 9 3 2 1 1 F dxz 7.210 -1 0 0 9
658 49 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 0 0 10
659 49 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 0 0 11
660 49 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 0 0 12
661 49 1 Cr 13 3 2 0 2 F dz2 3.913 -1 0 0 13
662 49 1 Cr 14 3 2 1 2 F dxz 3.913 -1 0 0 14
663 49 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 0 0 15
664 50 1 Cr 1 4 0 0 1 F s 9.697 -1 0 0 16
665 50 1 Cr 2 4 0 0 2 F s 8.001 -1 0 0 17
666 50 1 Cr 3 4 1 -1 1 F py 14.099 -1 0 0 18
667 50 1 Cr 4 4 1 0 1 F pz 14.099 -1 0 0 19
668 50 1 Cr 5 4 1 1 1 F px 14.099 -1 0 0 20
669 50 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 0 0 21
670 50 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 0 0 22
671 50 1 Cr 8 3 2 0 1 F dz2 7.210 -1 0 0 23
672 50 1 Cr 9 3 2 1 1 F dxz 7.210 -1 0 0 24
673 50 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 0 0 25
674 50 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 0 0 26
675 50 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 0 0 27
676 50 1 Cr 13 3 2 0 2 F dz2 3.913 -1 0 0 28
677 50 1 Cr 14 3 2 1 2 F dxz 3.913 -1 0 0 29
678 50 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 0 0 30
679 51 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 31
680 51 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 32
681 51 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 33
682 51 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 34
683 51 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 35
684 51 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 36
685 51 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 37
686 51 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 38
687 51 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 39
688 51 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 40
689 51 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 41
690 51 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 42
691 51 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 43
692 52 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 44
693 52 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 45
694 52 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 46
695 52 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 47
696 52 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 48
697 52 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 49
698 52 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 50
699 52 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 51
700 52 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 52
701 52 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 53
702 52 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 54
703 52 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 55
704 52 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 56
705 53 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 57
706 53 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 58
707 53 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 59
708 53 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 60
709 53 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 61
710 53 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 62
711 53 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 63
712 53 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 64
713 53 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 65
714 53 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 66
715 53 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 67
716 53 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 68
717 53 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 69
718 54 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 70
719 54 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 71
720 54 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 72
721 54 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 73
722 54 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 74
723 54 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 75
724 54 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 76
725 54 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 77
726 54 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 78
727 54 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 79
728 54 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 80
729 54 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 81
730 54 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 82
731 55 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 83
732 55 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 84
733 55 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 85
734 55 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 86
735 55 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 87
736 55 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 88
737 55 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 89
738 55 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 90
739 55 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 91
740 55 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 92
741 55 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 93
742 55 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 94
743 55 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 95
744 56 2 Br 1 4 0 0 1 F s 5.317 -1 0 0 96
745 56 2 Br 2 4 0 0 2 F s 3.476 -1 0 0 97
746 56 2 Br 3 4 1 -1 1 F py 6.996 -1 0 0 98
747 56 2 Br 4 4 1 0 1 F pz 6.996 -1 0 0 99
748 56 2 Br 5 4 1 1 1 F px 6.996 -1 0 0 100
749 56 2 Br 6 4 1 -1 2 F py 4.032 -1 0 0 101
750 56 2 Br 7 4 1 0 2 F pz 4.032 -1 0 0 102
751 56 2 Br 8 4 1 1 2 F px 4.032 -1 0 0 103
752 56 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 0 0 104
753 56 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 0 0 105
754 56 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 0 0 106
755 56 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 0 0 107
756 56 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 0 0 108
757 57 1 Cr 1 4 0 0 1 F s 9.697 0 1 0 1
758 57 1 Cr 2 4 0 0 2 F s 8.001 0 1 0 2
759 57 1 Cr 3 4 1 -1 1 F py 14.099 0 1 0 3
760 57 1 Cr 4 4 1 0 1 F pz 14.099 0 1 0 4
761 57 1 Cr 5 4 1 1 1 F px 14.099 0 1 0 5
762 57 1 Cr 6 3 2 -2 1 F dxy 7.210 0 1 0 6
763 57 1 Cr 7 3 2 -1 1 F dyz 7.210 0 1 0 7
764 57 1 Cr 8 3 2 0 1 F dz2 7.210 0 1 0 8
765 57 1 Cr 9 3 2 1 1 F dxz 7.210 0 1 0 9
766 57 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 1 0 10
767 57 1 Cr 11 3 2 -2 2 F dxy 3.913 0 1 0 11
768 57 1 Cr 12 3 2 -1 2 F dyz 3.913 0 1 0 12
769 57 1 Cr 13 3 2 0 2 F dz2 3.913 0 1 0 13
770 57 1 Cr 14 3 2 1 2 F dxz 3.913 0 1 0 14
771 57 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 1 0 15
772 58 1 Cr 1 4 0 0 1 F s 9.697 0 1 0 16
773 58 1 Cr 2 4 0 0 2 F s 8.001 0 1 0 17
774 58 1 Cr 3 4 1 -1 1 F py 14.099 0 1 0 18
775 58 1 Cr 4 4 1 0 1 F pz 14.099 0 1 0 19
776 58 1 Cr 5 4 1 1 1 F px 14.099 0 1 0 20
777 58 1 Cr 6 3 2 -2 1 F dxy 7.210 0 1 0 21
778 58 1 Cr 7 3 2 -1 1 F dyz 7.210 0 1 0 22
779 58 1 Cr 8 3 2 0 1 F dz2 7.210 0 1 0 23
780 58 1 Cr 9 3 2 1 1 F dxz 7.210 0 1 0 24
781 58 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 1 0 25
782 58 1 Cr 11 3 2 -2 2 F dxy 3.913 0 1 0 26
783 58 1 Cr 12 3 2 -1 2 F dyz 3.913 0 1 0 27
784 58 1 Cr 13 3 2 0 2 F dz2 3.913 0 1 0 28
785 58 1 Cr 14 3 2 1 2 F dxz 3.913 0 1 0 29
786 58 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 1 0 30
787 59 2 Br 1 4 0 0 1 F s 5.317 0 1 0 31
788 59 2 Br 2 4 0 0 2 F s 3.476 0 1 0 32
789 59 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 33
790 59 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 34
791 59 2 Br 5 4 1 1 1 F px 6.996 0 1 0 35
792 59 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 36
793 59 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 37
794 59 2 Br 8 4 1 1 2 F px 4.032 0 1 0 38
795 59 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 39
796 59 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 40
797 59 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 41
798 59 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 42
799 59 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 43
800 60 2 Br 1 4 0 0 1 F s 5.317 0 1 0 44
801 60 2 Br 2 4 0 0 2 F s 3.476 0 1 0 45
802 60 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 46
803 60 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 47
804 60 2 Br 5 4 1 1 1 F px 6.996 0 1 0 48
805 60 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 49
806 60 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 50
807 60 2 Br 8 4 1 1 2 F px 4.032 0 1 0 51
808 60 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 52
809 60 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 53
810 60 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 54
811 60 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 55
812 60 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 56
813 61 2 Br 1 4 0 0 1 F s 5.317 0 1 0 57
814 61 2 Br 2 4 0 0 2 F s 3.476 0 1 0 58
815 61 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 59
816 61 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 60
817 61 2 Br 5 4 1 1 1 F px 6.996 0 1 0 61
818 61 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 62
819 61 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 63
820 61 2 Br 8 4 1 1 2 F px 4.032 0 1 0 64
821 61 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 65
822 61 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 66
823 61 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 67
824 61 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 68
825 61 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 69
826 62 2 Br 1 4 0 0 1 F s 5.317 0 1 0 70
827 62 2 Br 2 4 0 0 2 F s 3.476 0 1 0 71
828 62 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 72
829 62 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 73
830 62 2 Br 5 4 1 1 1 F px 6.996 0 1 0 74
831 62 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 75
832 62 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 76
833 62 2 Br 8 4 1 1 2 F px 4.032 0 1 0 77
834 62 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 78
835 62 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 79
836 62 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 80
837 62 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 81
838 62 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 82
839 63 2 Br 1 4 0 0 1 F s 5.317 0 1 0 83
840 63 2 Br 2 4 0 0 2 F s 3.476 0 1 0 84
841 63 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 85
842 63 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 86
843 63 2 Br 5 4 1 1 1 F px 6.996 0 1 0 87
844 63 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 88
845 63 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 89
846 63 2 Br 8 4 1 1 2 F px 4.032 0 1 0 90
847 63 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 91
848 63 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 92
849 63 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 93
850 63 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 94
851 63 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 95
852 64 2 Br 1 4 0 0 1 F s 5.317 0 1 0 96
853 64 2 Br 2 4 0 0 2 F s 3.476 0 1 0 97
854 64 2 Br 3 4 1 -1 1 F py 6.996 0 1 0 98
855 64 2 Br 4 4 1 0 1 F pz 6.996 0 1 0 99
856 64 2 Br 5 4 1 1 1 F px 6.996 0 1 0 100
857 64 2 Br 6 4 1 -1 2 F py 4.032 0 1 0 101
858 64 2 Br 7 4 1 0 2 F pz 4.032 0 1 0 102
859 64 2 Br 8 4 1 1 2 F px 4.032 0 1 0 103
860 64 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 1 0 104
861 64 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 1 0 105
862 64 2 Br 11 4 2 0 1 T Pdz2 6.996 0 1 0 106
863 64 2 Br 12 4 2 1 1 T Pdxz 6.996 0 1 0 107
864 64 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 1 0 108
865 65 1 Cr 1 4 0 0 1 F s 9.697 1 1 0 1
866 65 1 Cr 2 4 0 0 2 F s 8.001 1 1 0 2
867 65 1 Cr 3 4 1 -1 1 F py 14.099 1 1 0 3
868 65 1 Cr 4 4 1 0 1 F pz 14.099 1 1 0 4
869 65 1 Cr 5 4 1 1 1 F px 14.099 1 1 0 5
870 65 1 Cr 6 3 2 -2 1 F dxy 7.210 1 1 0 6
871 65 1 Cr 7 3 2 -1 1 F dyz 7.210 1 1 0 7
872 65 1 Cr 8 3 2 0 1 F dz2 7.210 1 1 0 8
873 65 1 Cr 9 3 2 1 1 F dxz 7.210 1 1 0 9
874 65 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 1 0 10
875 65 1 Cr 11 3 2 -2 2 F dxy 3.913 1 1 0 11
876 65 1 Cr 12 3 2 -1 2 F dyz 3.913 1 1 0 12
877 65 1 Cr 13 3 2 0 2 F dz2 3.913 1 1 0 13
878 65 1 Cr 14 3 2 1 2 F dxz 3.913 1 1 0 14
879 65 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 1 0 15
880 66 1 Cr 1 4 0 0 1 F s 9.697 1 1 0 16
881 66 1 Cr 2 4 0 0 2 F s 8.001 1 1 0 17
882 66 1 Cr 3 4 1 -1 1 F py 14.099 1 1 0 18
883 66 1 Cr 4 4 1 0 1 F pz 14.099 1 1 0 19
884 66 1 Cr 5 4 1 1 1 F px 14.099 1 1 0 20
885 66 1 Cr 6 3 2 -2 1 F dxy 7.210 1 1 0 21
886 66 1 Cr 7 3 2 -1 1 F dyz 7.210 1 1 0 22
887 66 1 Cr 8 3 2 0 1 F dz2 7.210 1 1 0 23
888 66 1 Cr 9 3 2 1 1 F dxz 7.210 1 1 0 24
889 66 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 1 0 25
890 66 1 Cr 11 3 2 -2 2 F dxy 3.913 1 1 0 26
891 66 1 Cr 12 3 2 -1 2 F dyz 3.913 1 1 0 27
892 66 1 Cr 13 3 2 0 2 F dz2 3.913 1 1 0 28
893 66 1 Cr 14 3 2 1 2 F dxz 3.913 1 1 0 29
894 66 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 1 0 30
895 67 2 Br 1 4 0 0 1 F s 5.317 1 1 0 31
896 67 2 Br 2 4 0 0 2 F s 3.476 1 1 0 32
897 67 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 33
898 67 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 34
899 67 2 Br 5 4 1 1 1 F px 6.996 1 1 0 35
900 67 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 36
901 67 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 37
902 67 2 Br 8 4 1 1 2 F px 4.032 1 1 0 38
903 67 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 39
904 67 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 40
905 67 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 41
906 67 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 42
907 67 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 43
908 68 2 Br 1 4 0 0 1 F s 5.317 1 1 0 44
909 68 2 Br 2 4 0 0 2 F s 3.476 1 1 0 45
910 68 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 46
911 68 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 47
912 68 2 Br 5 4 1 1 1 F px 6.996 1 1 0 48
913 68 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 49
914 68 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 50
915 68 2 Br 8 4 1 1 2 F px 4.032 1 1 0 51
916 68 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 52
917 68 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 53
918 68 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 54
919 68 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 55
920 68 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 56
921 69 2 Br 1 4 0 0 1 F s 5.317 1 1 0 57
922 69 2 Br 2 4 0 0 2 F s 3.476 1 1 0 58
923 69 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 59
924 69 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 60
925 69 2 Br 5 4 1 1 1 F px 6.996 1 1 0 61
926 69 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 62
927 69 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 63
928 69 2 Br 8 4 1 1 2 F px 4.032 1 1 0 64
929 69 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 65
930 69 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 66
931 69 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 67
932 69 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 68
933 69 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 69
934 70 2 Br 1 4 0 0 1 F s 5.317 1 1 0 70
935 70 2 Br 2 4 0 0 2 F s 3.476 1 1 0 71
936 70 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 72
937 70 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 73
938 70 2 Br 5 4 1 1 1 F px 6.996 1 1 0 74
939 70 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 75
940 70 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 76
941 70 2 Br 8 4 1 1 2 F px 4.032 1 1 0 77
942 70 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 78
943 70 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 79
944 70 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 80
945 70 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 81
946 70 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 82
947 71 2 Br 1 4 0 0 1 F s 5.317 1 1 0 83
948 71 2 Br 2 4 0 0 2 F s 3.476 1 1 0 84
949 71 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 85
950 71 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 86
951 71 2 Br 5 4 1 1 1 F px 6.996 1 1 0 87
952 71 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 88
953 71 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 89
954 71 2 Br 8 4 1 1 2 F px 4.032 1 1 0 90
955 71 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 91
956 71 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 92
957 71 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 93
958 71 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 94
959 71 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 95
960 72 2 Br 1 4 0 0 1 F s 5.317 1 1 0 96
961 72 2 Br 2 4 0 0 2 F s 3.476 1 1 0 97
962 72 2 Br 3 4 1 -1 1 F py 6.996 1 1 0 98
963 72 2 Br 4 4 1 0 1 F pz 6.996 1 1 0 99
964 72 2 Br 5 4 1 1 1 F px 6.996 1 1 0 100
965 72 2 Br 6 4 1 -1 2 F py 4.032 1 1 0 101
966 72 2 Br 7 4 1 0 2 F pz 4.032 1 1 0 102
967 72 2 Br 8 4 1 1 2 F px 4.032 1 1 0 103
968 72 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 1 0 104
969 72 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 1 0 105
970 72 2 Br 11 4 2 0 1 T Pdz2 6.996 1 1 0 106
971 72 2 Br 12 4 2 1 1 T Pdxz 6.996 1 1 0 107
972 72 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 1 0 108
973 73 1 Cr 1 4 0 0 1 F s 9.697 2 1 0 1
974 73 1 Cr 2 4 0 0 2 F s 8.001 2 1 0 2
975 73 1 Cr 3 4 1 -1 1 F py 14.099 2 1 0 3
976 73 1 Cr 4 4 1 0 1 F pz 14.099 2 1 0 4
977 73 1 Cr 5 4 1 1 1 F px 14.099 2 1 0 5
978 73 1 Cr 6 3 2 -2 1 F dxy 7.210 2 1 0 6
979 73 1 Cr 7 3 2 -1 1 F dyz 7.210 2 1 0 7
980 73 1 Cr 8 3 2 0 1 F dz2 7.210 2 1 0 8
981 73 1 Cr 9 3 2 1 1 F dxz 7.210 2 1 0 9
982 73 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 1 0 10
983 73 1 Cr 11 3 2 -2 2 F dxy 3.913 2 1 0 11
984 73 1 Cr 12 3 2 -1 2 F dyz 3.913 2 1 0 12
985 73 1 Cr 13 3 2 0 2 F dz2 3.913 2 1 0 13
986 73 1 Cr 14 3 2 1 2 F dxz 3.913 2 1 0 14
987 73 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 1 0 15
988 74 1 Cr 1 4 0 0 1 F s 9.697 2 1 0 16
989 74 1 Cr 2 4 0 0 2 F s 8.001 2 1 0 17
990 74 1 Cr 3 4 1 -1 1 F py 14.099 2 1 0 18
991 74 1 Cr 4 4 1 0 1 F pz 14.099 2 1 0 19
992 74 1 Cr 5 4 1 1 1 F px 14.099 2 1 0 20
993 74 1 Cr 6 3 2 -2 1 F dxy 7.210 2 1 0 21
994 74 1 Cr 7 3 2 -1 1 F dyz 7.210 2 1 0 22
995 74 1 Cr 8 3 2 0 1 F dz2 7.210 2 1 0 23
996 74 1 Cr 9 3 2 1 1 F dxz 7.210 2 1 0 24
997 74 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 1 0 25
998 74 1 Cr 11 3 2 -2 2 F dxy 3.913 2 1 0 26
999 74 1 Cr 12 3 2 -1 2 F dyz 3.913 2 1 0 27
1000 74 1 Cr 13 3 2 0 2 F dz2 3.913 2 1 0 28
1001 74 1 Cr 14 3 2 1 2 F dxz 3.913 2 1 0 29
1002 74 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 1 0 30
1003 75 2 Br 1 4 0 0 1 F s 5.317 2 1 0 31
1004 75 2 Br 2 4 0 0 2 F s 3.476 2 1 0 32
1005 75 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 33
1006 75 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 34
1007 75 2 Br 5 4 1 1 1 F px 6.996 2 1 0 35
1008 75 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 36
1009 75 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 37
1010 75 2 Br 8 4 1 1 2 F px 4.032 2 1 0 38
1011 75 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 39
1012 75 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 40
1013 75 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 41
1014 75 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 42
1015 75 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 43
1016 76 2 Br 1 4 0 0 1 F s 5.317 2 1 0 44
1017 76 2 Br 2 4 0 0 2 F s 3.476 2 1 0 45
1018 76 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 46
1019 76 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 47
1020 76 2 Br 5 4 1 1 1 F px 6.996 2 1 0 48
1021 76 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 49
1022 76 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 50
1023 76 2 Br 8 4 1 1 2 F px 4.032 2 1 0 51
1024 76 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 52
1025 76 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 53
1026 76 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 54
1027 76 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 55
1028 76 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 56
1029 77 2 Br 1 4 0 0 1 F s 5.317 2 1 0 57
1030 77 2 Br 2 4 0 0 2 F s 3.476 2 1 0 58
1031 77 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 59
1032 77 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 60
1033 77 2 Br 5 4 1 1 1 F px 6.996 2 1 0 61
1034 77 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 62
1035 77 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 63
1036 77 2 Br 8 4 1 1 2 F px 4.032 2 1 0 64
1037 77 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 65
1038 77 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 66
1039 77 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 67
1040 77 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 68
1041 77 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 69
1042 78 2 Br 1 4 0 0 1 F s 5.317 2 1 0 70
1043 78 2 Br 2 4 0 0 2 F s 3.476 2 1 0 71
1044 78 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 72
1045 78 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 73
1046 78 2 Br 5 4 1 1 1 F px 6.996 2 1 0 74
1047 78 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 75
1048 78 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 76
1049 78 2 Br 8 4 1 1 2 F px 4.032 2 1 0 77
1050 78 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 78
1051 78 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 79
1052 78 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 80
1053 78 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 81
1054 78 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 82
1055 79 2 Br 1 4 0 0 1 F s 5.317 2 1 0 83
1056 79 2 Br 2 4 0 0 2 F s 3.476 2 1 0 84
1057 79 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 85
1058 79 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 86
1059 79 2 Br 5 4 1 1 1 F px 6.996 2 1 0 87
1060 79 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 88
1061 79 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 89
1062 79 2 Br 8 4 1 1 2 F px 4.032 2 1 0 90
1063 79 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 91
1064 79 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 92
1065 79 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 93
1066 79 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 94
1067 79 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 95
1068 80 2 Br 1 4 0 0 1 F s 5.317 2 1 0 96
1069 80 2 Br 2 4 0 0 2 F s 3.476 2 1 0 97
1070 80 2 Br 3 4 1 -1 1 F py 6.996 2 1 0 98
1071 80 2 Br 4 4 1 0 1 F pz 6.996 2 1 0 99
1072 80 2 Br 5 4 1 1 1 F px 6.996 2 1 0 100
1073 80 2 Br 6 4 1 -1 2 F py 4.032 2 1 0 101
1074 80 2 Br 7 4 1 0 2 F pz 4.032 2 1 0 102
1075 80 2 Br 8 4 1 1 2 F px 4.032 2 1 0 103
1076 80 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 1 0 104
1077 80 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 1 0 105
1078 80 2 Br 11 4 2 0 1 T Pdz2 6.996 2 1 0 106
1079 80 2 Br 12 4 2 1 1 T Pdxz 6.996 2 1 0 107
1080 80 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 1 0 108
1081 81 1 Cr 1 4 0 0 1 F s 9.697 3 1 0 1
1082 81 1 Cr 2 4 0 0 2 F s 8.001 3 1 0 2
1083 81 1 Cr 3 4 1 -1 1 F py 14.099 3 1 0 3
1084 81 1 Cr 4 4 1 0 1 F pz 14.099 3 1 0 4
1085 81 1 Cr 5 4 1 1 1 F px 14.099 3 1 0 5
1086 81 1 Cr 6 3 2 -2 1 F dxy 7.210 3 1 0 6
1087 81 1 Cr 7 3 2 -1 1 F dyz 7.210 3 1 0 7
1088 81 1 Cr 8 3 2 0 1 F dz2 7.210 3 1 0 8
1089 81 1 Cr 9 3 2 1 1 F dxz 7.210 3 1 0 9
1090 81 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 1 0 10
1091 81 1 Cr 11 3 2 -2 2 F dxy 3.913 3 1 0 11
1092 81 1 Cr 12 3 2 -1 2 F dyz 3.913 3 1 0 12
1093 81 1 Cr 13 3 2 0 2 F dz2 3.913 3 1 0 13
1094 81 1 Cr 14 3 2 1 2 F dxz 3.913 3 1 0 14
1095 81 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 1 0 15
1096 82 1 Cr 1 4 0 0 1 F s 9.697 3 1 0 16
1097 82 1 Cr 2 4 0 0 2 F s 8.001 3 1 0 17
1098 82 1 Cr 3 4 1 -1 1 F py 14.099 3 1 0 18
1099 82 1 Cr 4 4 1 0 1 F pz 14.099 3 1 0 19
1100 82 1 Cr 5 4 1 1 1 F px 14.099 3 1 0 20
1101 82 1 Cr 6 3 2 -2 1 F dxy 7.210 3 1 0 21
1102 82 1 Cr 7 3 2 -1 1 F dyz 7.210 3 1 0 22
1103 82 1 Cr 8 3 2 0 1 F dz2 7.210 3 1 0 23
1104 82 1 Cr 9 3 2 1 1 F dxz 7.210 3 1 0 24
1105 82 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 1 0 25
1106 82 1 Cr 11 3 2 -2 2 F dxy 3.913 3 1 0 26
1107 82 1 Cr 12 3 2 -1 2 F dyz 3.913 3 1 0 27
1108 82 1 Cr 13 3 2 0 2 F dz2 3.913 3 1 0 28
1109 82 1 Cr 14 3 2 1 2 F dxz 3.913 3 1 0 29
1110 82 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 1 0 30
1111 83 2 Br 1 4 0 0 1 F s 5.317 3 1 0 31
1112 83 2 Br 2 4 0 0 2 F s 3.476 3 1 0 32
1113 83 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 33
1114 83 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 34
1115 83 2 Br 5 4 1 1 1 F px 6.996 3 1 0 35
1116 83 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 36
1117 83 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 37
1118 83 2 Br 8 4 1 1 2 F px 4.032 3 1 0 38
1119 83 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 39
1120 83 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 40
1121 83 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 41
1122 83 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 42
1123 83 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 43
1124 84 2 Br 1 4 0 0 1 F s 5.317 3 1 0 44
1125 84 2 Br 2 4 0 0 2 F s 3.476 3 1 0 45
1126 84 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 46
1127 84 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 47
1128 84 2 Br 5 4 1 1 1 F px 6.996 3 1 0 48
1129 84 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 49
1130 84 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 50
1131 84 2 Br 8 4 1 1 2 F px 4.032 3 1 0 51
1132 84 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 52
1133 84 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 53
1134 84 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 54
1135 84 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 55
1136 84 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 56
1137 85 2 Br 1 4 0 0 1 F s 5.317 3 1 0 57
1138 85 2 Br 2 4 0 0 2 F s 3.476 3 1 0 58
1139 85 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 59
1140 85 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 60
1141 85 2 Br 5 4 1 1 1 F px 6.996 3 1 0 61
1142 85 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 62
1143 85 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 63
1144 85 2 Br 8 4 1 1 2 F px 4.032 3 1 0 64
1145 85 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 65
1146 85 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 66
1147 85 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 67
1148 85 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 68
1149 85 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 69
1150 86 2 Br 1 4 0 0 1 F s 5.317 3 1 0 70
1151 86 2 Br 2 4 0 0 2 F s 3.476 3 1 0 71
1152 86 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 72
1153 86 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 73
1154 86 2 Br 5 4 1 1 1 F px 6.996 3 1 0 74
1155 86 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 75
1156 86 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 76
1157 86 2 Br 8 4 1 1 2 F px 4.032 3 1 0 77
1158 86 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 78
1159 86 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 79
1160 86 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 80
1161 86 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 81
1162 86 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 82
1163 87 2 Br 1 4 0 0 1 F s 5.317 3 1 0 83
1164 87 2 Br 2 4 0 0 2 F s 3.476 3 1 0 84
1165 87 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 85
1166 87 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 86
1167 87 2 Br 5 4 1 1 1 F px 6.996 3 1 0 87
1168 87 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 88
1169 87 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 89
1170 87 2 Br 8 4 1 1 2 F px 4.032 3 1 0 90
1171 87 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 91
1172 87 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 92
1173 87 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 93
1174 87 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 94
1175 87 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 95
1176 88 2 Br 1 4 0 0 1 F s 5.317 3 1 0 96
1177 88 2 Br 2 4 0 0 2 F s 3.476 3 1 0 97
1178 88 2 Br 3 4 1 -1 1 F py 6.996 3 1 0 98
1179 88 2 Br 4 4 1 0 1 F pz 6.996 3 1 0 99
1180 88 2 Br 5 4 1 1 1 F px 6.996 3 1 0 100
1181 88 2 Br 6 4 1 -1 2 F py 4.032 3 1 0 101
1182 88 2 Br 7 4 1 0 2 F pz 4.032 3 1 0 102
1183 88 2 Br 8 4 1 1 2 F px 4.032 3 1 0 103
1184 88 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 1 0 104
1185 88 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 1 0 105
1186 88 2 Br 11 4 2 0 1 T Pdz2 6.996 3 1 0 106
1187 88 2 Br 12 4 2 1 1 T Pdxz 6.996 3 1 0 107
1188 88 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 1 0 108
1189 89 1 Cr 1 4 0 0 1 F s 9.697 -3 1 0 1
1190 89 1 Cr 2 4 0 0 2 F s 8.001 -3 1 0 2
1191 89 1 Cr 3 4 1 -1 1 F py 14.099 -3 1 0 3
1192 89 1 Cr 4 4 1 0 1 F pz 14.099 -3 1 0 4
1193 89 1 Cr 5 4 1 1 1 F px 14.099 -3 1 0 5
1194 89 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 1 0 6
1195 89 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 1 0 7
1196 89 1 Cr 8 3 2 0 1 F dz2 7.210 -3 1 0 8
1197 89 1 Cr 9 3 2 1 1 F dxz 7.210 -3 1 0 9
1198 89 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 1 0 10
1199 89 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 1 0 11
1200 89 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 1 0 12
1201 89 1 Cr 13 3 2 0 2 F dz2 3.913 -3 1 0 13
1202 89 1 Cr 14 3 2 1 2 F dxz 3.913 -3 1 0 14
1203 89 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 1 0 15
1204 90 1 Cr 1 4 0 0 1 F s 9.697 -3 1 0 16
1205 90 1 Cr 2 4 0 0 2 F s 8.001 -3 1 0 17
1206 90 1 Cr 3 4 1 -1 1 F py 14.099 -3 1 0 18
1207 90 1 Cr 4 4 1 0 1 F pz 14.099 -3 1 0 19
1208 90 1 Cr 5 4 1 1 1 F px 14.099 -3 1 0 20
1209 90 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 1 0 21
1210 90 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 1 0 22
1211 90 1 Cr 8 3 2 0 1 F dz2 7.210 -3 1 0 23
1212 90 1 Cr 9 3 2 1 1 F dxz 7.210 -3 1 0 24
1213 90 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 1 0 25
1214 90 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 1 0 26
1215 90 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 1 0 27
1216 90 1 Cr 13 3 2 0 2 F dz2 3.913 -3 1 0 28
1217 90 1 Cr 14 3 2 1 2 F dxz 3.913 -3 1 0 29
1218 90 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 1 0 30
1219 91 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 31
1220 91 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 32
1221 91 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 33
1222 91 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 34
1223 91 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 35
1224 91 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 36
1225 91 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 37
1226 91 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 38
1227 91 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 39
1228 91 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 40
1229 91 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 41
1230 91 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 42
1231 91 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 43
1232 92 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 44
1233 92 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 45
1234 92 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 46
1235 92 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 47
1236 92 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 48
1237 92 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 49
1238 92 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 50
1239 92 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 51
1240 92 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 52
1241 92 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 53
1242 92 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 54
1243 92 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 55
1244 92 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 56
1245 93 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 57
1246 93 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 58
1247 93 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 59
1248 93 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 60
1249 93 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 61
1250 93 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 62
1251 93 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 63
1252 93 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 64
1253 93 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 65
1254 93 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 66
1255 93 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 67
1256 93 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 68
1257 93 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 69
1258 94 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 70
1259 94 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 71
1260 94 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 72
1261 94 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 73
1262 94 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 74
1263 94 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 75
1264 94 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 76
1265 94 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 77
1266 94 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 78
1267 94 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 79
1268 94 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 80
1269 94 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 81
1270 94 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 82
1271 95 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 83
1272 95 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 84
1273 95 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 85
1274 95 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 86
1275 95 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 87
1276 95 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 88
1277 95 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 89
1278 95 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 90
1279 95 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 91
1280 95 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 92
1281 95 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 93
1282 95 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 94
1283 95 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 95
1284 96 2 Br 1 4 0 0 1 F s 5.317 -3 1 0 96
1285 96 2 Br 2 4 0 0 2 F s 3.476 -3 1 0 97
1286 96 2 Br 3 4 1 -1 1 F py 6.996 -3 1 0 98
1287 96 2 Br 4 4 1 0 1 F pz 6.996 -3 1 0 99
1288 96 2 Br 5 4 1 1 1 F px 6.996 -3 1 0 100
1289 96 2 Br 6 4 1 -1 2 F py 4.032 -3 1 0 101
1290 96 2 Br 7 4 1 0 2 F pz 4.032 -3 1 0 102
1291 96 2 Br 8 4 1 1 2 F px 4.032 -3 1 0 103
1292 96 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 1 0 104
1293 96 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 1 0 105
1294 96 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 1 0 106
1295 96 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 1 0 107
1296 96 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 1 0 108
1297 97 1 Cr 1 4 0 0 1 F s 9.697 -2 1 0 1
1298 97 1 Cr 2 4 0 0 2 F s 8.001 -2 1 0 2
1299 97 1 Cr 3 4 1 -1 1 F py 14.099 -2 1 0 3
1300 97 1 Cr 4 4 1 0 1 F pz 14.099 -2 1 0 4
1301 97 1 Cr 5 4 1 1 1 F px 14.099 -2 1 0 5
1302 97 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 1 0 6
1303 97 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 1 0 7
1304 97 1 Cr 8 3 2 0 1 F dz2 7.210 -2 1 0 8
1305 97 1 Cr 9 3 2 1 1 F dxz 7.210 -2 1 0 9
1306 97 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 1 0 10
1307 97 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 1 0 11
1308 97 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 1 0 12
1309 97 1 Cr 13 3 2 0 2 F dz2 3.913 -2 1 0 13
1310 97 1 Cr 14 3 2 1 2 F dxz 3.913 -2 1 0 14
1311 97 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 1 0 15
1312 98 1 Cr 1 4 0 0 1 F s 9.697 -2 1 0 16
1313 98 1 Cr 2 4 0 0 2 F s 8.001 -2 1 0 17
1314 98 1 Cr 3 4 1 -1 1 F py 14.099 -2 1 0 18
1315 98 1 Cr 4 4 1 0 1 F pz 14.099 -2 1 0 19
1316 98 1 Cr 5 4 1 1 1 F px 14.099 -2 1 0 20
1317 98 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 1 0 21
1318 98 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 1 0 22
1319 98 1 Cr 8 3 2 0 1 F dz2 7.210 -2 1 0 23
1320 98 1 Cr 9 3 2 1 1 F dxz 7.210 -2 1 0 24
1321 98 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 1 0 25
1322 98 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 1 0 26
1323 98 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 1 0 27
1324 98 1 Cr 13 3 2 0 2 F dz2 3.913 -2 1 0 28
1325 98 1 Cr 14 3 2 1 2 F dxz 3.913 -2 1 0 29
1326 98 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 1 0 30
1327 99 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 31
1328 99 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 32
1329 99 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 33
1330 99 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 34
1331 99 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 35
1332 99 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 36
1333 99 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 37
1334 99 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 38
1335 99 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 39
1336 99 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 40
1337 99 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 41
1338 99 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 42
1339 99 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 43
1340 100 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 44
1341 100 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 45
1342 100 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 46
1343 100 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 47
1344 100 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 48
1345 100 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 49
1346 100 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 50
1347 100 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 51
1348 100 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 52
1349 100 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 53
1350 100 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 54
1351 100 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 55
1352 100 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 56
1353 101 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 57
1354 101 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 58
1355 101 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 59
1356 101 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 60
1357 101 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 61
1358 101 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 62
1359 101 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 63
1360 101 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 64
1361 101 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 65
1362 101 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 66
1363 101 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 67
1364 101 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 68
1365 101 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 69
1366 102 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 70
1367 102 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 71
1368 102 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 72
1369 102 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 73
1370 102 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 74
1371 102 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 75
1372 102 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 76
1373 102 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 77
1374 102 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 78
1375 102 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 79
1376 102 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 80
1377 102 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 81
1378 102 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 82
1379 103 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 83
1380 103 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 84
1381 103 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 85
1382 103 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 86
1383 103 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 87
1384 103 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 88
1385 103 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 89
1386 103 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 90
1387 103 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 91
1388 103 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 92
1389 103 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 93
1390 103 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 94
1391 103 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 95
1392 104 2 Br 1 4 0 0 1 F s 5.317 -2 1 0 96
1393 104 2 Br 2 4 0 0 2 F s 3.476 -2 1 0 97
1394 104 2 Br 3 4 1 -1 1 F py 6.996 -2 1 0 98
1395 104 2 Br 4 4 1 0 1 F pz 6.996 -2 1 0 99
1396 104 2 Br 5 4 1 1 1 F px 6.996 -2 1 0 100
1397 104 2 Br 6 4 1 -1 2 F py 4.032 -2 1 0 101
1398 104 2 Br 7 4 1 0 2 F pz 4.032 -2 1 0 102
1399 104 2 Br 8 4 1 1 2 F px 4.032 -2 1 0 103
1400 104 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 1 0 104
1401 104 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 1 0 105
1402 104 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 1 0 106
1403 104 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 1 0 107
1404 104 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 1 0 108
1405 105 1 Cr 1 4 0 0 1 F s 9.697 -1 1 0 1
1406 105 1 Cr 2 4 0 0 2 F s 8.001 -1 1 0 2
1407 105 1 Cr 3 4 1 -1 1 F py 14.099 -1 1 0 3
1408 105 1 Cr 4 4 1 0 1 F pz 14.099 -1 1 0 4
1409 105 1 Cr 5 4 1 1 1 F px 14.099 -1 1 0 5
1410 105 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 1 0 6
1411 105 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 1 0 7
1412 105 1 Cr 8 3 2 0 1 F dz2 7.210 -1 1 0 8
1413 105 1 Cr 9 3 2 1 1 F dxz 7.210 -1 1 0 9
1414 105 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 1 0 10
1415 105 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 1 0 11
1416 105 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 1 0 12
1417 105 1 Cr 13 3 2 0 2 F dz2 3.913 -1 1 0 13
1418 105 1 Cr 14 3 2 1 2 F dxz 3.913 -1 1 0 14
1419 105 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 1 0 15
1420 106 1 Cr 1 4 0 0 1 F s 9.697 -1 1 0 16
1421 106 1 Cr 2 4 0 0 2 F s 8.001 -1 1 0 17
1422 106 1 Cr 3 4 1 -1 1 F py 14.099 -1 1 0 18
1423 106 1 Cr 4 4 1 0 1 F pz 14.099 -1 1 0 19
1424 106 1 Cr 5 4 1 1 1 F px 14.099 -1 1 0 20
1425 106 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 1 0 21
1426 106 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 1 0 22
1427 106 1 Cr 8 3 2 0 1 F dz2 7.210 -1 1 0 23
1428 106 1 Cr 9 3 2 1 1 F dxz 7.210 -1 1 0 24
1429 106 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 1 0 25
1430 106 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 1 0 26
1431 106 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 1 0 27
1432 106 1 Cr 13 3 2 0 2 F dz2 3.913 -1 1 0 28
1433 106 1 Cr 14 3 2 1 2 F dxz 3.913 -1 1 0 29
1434 106 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 1 0 30
1435 107 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 31
1436 107 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 32
1437 107 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 33
1438 107 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 34
1439 107 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 35
1440 107 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 36
1441 107 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 37
1442 107 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 38
1443 107 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 39
1444 107 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 40
1445 107 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 41
1446 107 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 42
1447 107 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 43
1448 108 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 44
1449 108 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 45
1450 108 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 46
1451 108 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 47
1452 108 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 48
1453 108 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 49
1454 108 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 50
1455 108 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 51
1456 108 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 52
1457 108 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 53
1458 108 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 54
1459 108 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 55
1460 108 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 56
1461 109 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 57
1462 109 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 58
1463 109 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 59
1464 109 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 60
1465 109 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 61
1466 109 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 62
1467 109 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 63
1468 109 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 64
1469 109 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 65
1470 109 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 66
1471 109 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 67
1472 109 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 68
1473 109 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 69
1474 110 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 70
1475 110 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 71
1476 110 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 72
1477 110 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 73
1478 110 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 74
1479 110 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 75
1480 110 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 76
1481 110 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 77
1482 110 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 78
1483 110 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 79
1484 110 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 80
1485 110 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 81
1486 110 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 82
1487 111 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 83
1488 111 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 84
1489 111 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 85
1490 111 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 86
1491 111 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 87
1492 111 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 88
1493 111 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 89
1494 111 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 90
1495 111 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 91
1496 111 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 92
1497 111 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 93
1498 111 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 94
1499 111 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 95
1500 112 2 Br 1 4 0 0 1 F s 5.317 -1 1 0 96
1501 112 2 Br 2 4 0 0 2 F s 3.476 -1 1 0 97
1502 112 2 Br 3 4 1 -1 1 F py 6.996 -1 1 0 98
1503 112 2 Br 4 4 1 0 1 F pz 6.996 -1 1 0 99
1504 112 2 Br 5 4 1 1 1 F px 6.996 -1 1 0 100
1505 112 2 Br 6 4 1 -1 2 F py 4.032 -1 1 0 101
1506 112 2 Br 7 4 1 0 2 F pz 4.032 -1 1 0 102
1507 112 2 Br 8 4 1 1 2 F px 4.032 -1 1 0 103
1508 112 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 1 0 104
1509 112 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 1 0 105
1510 112 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 1 0 106
1511 112 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 1 0 107
1512 112 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 1 0 108
1513 113 1 Cr 1 4 0 0 1 F s 9.697 0 2 0 1
1514 113 1 Cr 2 4 0 0 2 F s 8.001 0 2 0 2
1515 113 1 Cr 3 4 1 -1 1 F py 14.099 0 2 0 3
1516 113 1 Cr 4 4 1 0 1 F pz 14.099 0 2 0 4
1517 113 1 Cr 5 4 1 1 1 F px 14.099 0 2 0 5
1518 113 1 Cr 6 3 2 -2 1 F dxy 7.210 0 2 0 6
1519 113 1 Cr 7 3 2 -1 1 F dyz 7.210 0 2 0 7
1520 113 1 Cr 8 3 2 0 1 F dz2 7.210 0 2 0 8
1521 113 1 Cr 9 3 2 1 1 F dxz 7.210 0 2 0 9
1522 113 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 2 0 10
1523 113 1 Cr 11 3 2 -2 2 F dxy 3.913 0 2 0 11
1524 113 1 Cr 12 3 2 -1 2 F dyz 3.913 0 2 0 12
1525 113 1 Cr 13 3 2 0 2 F dz2 3.913 0 2 0 13
1526 113 1 Cr 14 3 2 1 2 F dxz 3.913 0 2 0 14
1527 113 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 2 0 15
1528 114 1 Cr 1 4 0 0 1 F s 9.697 0 2 0 16
1529 114 1 Cr 2 4 0 0 2 F s 8.001 0 2 0 17
1530 114 1 Cr 3 4 1 -1 1 F py 14.099 0 2 0 18
1531 114 1 Cr 4 4 1 0 1 F pz 14.099 0 2 0 19
1532 114 1 Cr 5 4 1 1 1 F px 14.099 0 2 0 20
1533 114 1 Cr 6 3 2 -2 1 F dxy 7.210 0 2 0 21
1534 114 1 Cr 7 3 2 -1 1 F dyz 7.210 0 2 0 22
1535 114 1 Cr 8 3 2 0 1 F dz2 7.210 0 2 0 23
1536 114 1 Cr 9 3 2 1 1 F dxz 7.210 0 2 0 24
1537 114 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 2 0 25
1538 114 1 Cr 11 3 2 -2 2 F dxy 3.913 0 2 0 26
1539 114 1 Cr 12 3 2 -1 2 F dyz 3.913 0 2 0 27
1540 114 1 Cr 13 3 2 0 2 F dz2 3.913 0 2 0 28
1541 114 1 Cr 14 3 2 1 2 F dxz 3.913 0 2 0 29
1542 114 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 2 0 30
1543 115 2 Br 1 4 0 0 1 F s 5.317 0 2 0 31
1544 115 2 Br 2 4 0 0 2 F s 3.476 0 2 0 32
1545 115 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 33
1546 115 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 34
1547 115 2 Br 5 4 1 1 1 F px 6.996 0 2 0 35
1548 115 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 36
1549 115 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 37
1550 115 2 Br 8 4 1 1 2 F px 4.032 0 2 0 38
1551 115 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 39
1552 115 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 40
1553 115 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 41
1554 115 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 42
1555 115 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 43
1556 116 2 Br 1 4 0 0 1 F s 5.317 0 2 0 44
1557 116 2 Br 2 4 0 0 2 F s 3.476 0 2 0 45
1558 116 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 46
1559 116 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 47
1560 116 2 Br 5 4 1 1 1 F px 6.996 0 2 0 48
1561 116 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 49
1562 116 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 50
1563 116 2 Br 8 4 1 1 2 F px 4.032 0 2 0 51
1564 116 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 52
1565 116 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 53
1566 116 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 54
1567 116 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 55
1568 116 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 56
1569 117 2 Br 1 4 0 0 1 F s 5.317 0 2 0 57
1570 117 2 Br 2 4 0 0 2 F s 3.476 0 2 0 58
1571 117 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 59
1572 117 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 60
1573 117 2 Br 5 4 1 1 1 F px 6.996 0 2 0 61
1574 117 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 62
1575 117 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 63
1576 117 2 Br 8 4 1 1 2 F px 4.032 0 2 0 64
1577 117 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 65
1578 117 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 66
1579 117 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 67
1580 117 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 68
1581 117 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 69
1582 118 2 Br 1 4 0 0 1 F s 5.317 0 2 0 70
1583 118 2 Br 2 4 0 0 2 F s 3.476 0 2 0 71
1584 118 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 72
1585 118 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 73
1586 118 2 Br 5 4 1 1 1 F px 6.996 0 2 0 74
1587 118 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 75
1588 118 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 76
1589 118 2 Br 8 4 1 1 2 F px 4.032 0 2 0 77
1590 118 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 78
1591 118 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 79
1592 118 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 80
1593 118 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 81
1594 118 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 82
1595 119 2 Br 1 4 0 0 1 F s 5.317 0 2 0 83
1596 119 2 Br 2 4 0 0 2 F s 3.476 0 2 0 84
1597 119 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 85
1598 119 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 86
1599 119 2 Br 5 4 1 1 1 F px 6.996 0 2 0 87
1600 119 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 88
1601 119 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 89
1602 119 2 Br 8 4 1 1 2 F px 4.032 0 2 0 90
1603 119 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 91
1604 119 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 92
1605 119 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 93
1606 119 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 94
1607 119 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 95
1608 120 2 Br 1 4 0 0 1 F s 5.317 0 2 0 96
1609 120 2 Br 2 4 0 0 2 F s 3.476 0 2 0 97
1610 120 2 Br 3 4 1 -1 1 F py 6.996 0 2 0 98
1611 120 2 Br 4 4 1 0 1 F pz 6.996 0 2 0 99
1612 120 2 Br 5 4 1 1 1 F px 6.996 0 2 0 100
1613 120 2 Br 6 4 1 -1 2 F py 4.032 0 2 0 101
1614 120 2 Br 7 4 1 0 2 F pz 4.032 0 2 0 102
1615 120 2 Br 8 4 1 1 2 F px 4.032 0 2 0 103
1616 120 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 2 0 104
1617 120 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 2 0 105
1618 120 2 Br 11 4 2 0 1 T Pdz2 6.996 0 2 0 106
1619 120 2 Br 12 4 2 1 1 T Pdxz 6.996 0 2 0 107
1620 120 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 2 0 108
1621 121 1 Cr 1 4 0 0 1 F s 9.697 1 2 0 1
1622 121 1 Cr 2 4 0 0 2 F s 8.001 1 2 0 2
1623 121 1 Cr 3 4 1 -1 1 F py 14.099 1 2 0 3
1624 121 1 Cr 4 4 1 0 1 F pz 14.099 1 2 0 4
1625 121 1 Cr 5 4 1 1 1 F px 14.099 1 2 0 5
1626 121 1 Cr 6 3 2 -2 1 F dxy 7.210 1 2 0 6
1627 121 1 Cr 7 3 2 -1 1 F dyz 7.210 1 2 0 7
1628 121 1 Cr 8 3 2 0 1 F dz2 7.210 1 2 0 8
1629 121 1 Cr 9 3 2 1 1 F dxz 7.210 1 2 0 9
1630 121 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 2 0 10
1631 121 1 Cr 11 3 2 -2 2 F dxy 3.913 1 2 0 11
1632 121 1 Cr 12 3 2 -1 2 F dyz 3.913 1 2 0 12
1633 121 1 Cr 13 3 2 0 2 F dz2 3.913 1 2 0 13
1634 121 1 Cr 14 3 2 1 2 F dxz 3.913 1 2 0 14
1635 121 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 2 0 15
1636 122 1 Cr 1 4 0 0 1 F s 9.697 1 2 0 16
1637 122 1 Cr 2 4 0 0 2 F s 8.001 1 2 0 17
1638 122 1 Cr 3 4 1 -1 1 F py 14.099 1 2 0 18
1639 122 1 Cr 4 4 1 0 1 F pz 14.099 1 2 0 19
1640 122 1 Cr 5 4 1 1 1 F px 14.099 1 2 0 20
1641 122 1 Cr 6 3 2 -2 1 F dxy 7.210 1 2 0 21
1642 122 1 Cr 7 3 2 -1 1 F dyz 7.210 1 2 0 22
1643 122 1 Cr 8 3 2 0 1 F dz2 7.210 1 2 0 23
1644 122 1 Cr 9 3 2 1 1 F dxz 7.210 1 2 0 24
1645 122 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 2 0 25
1646 122 1 Cr 11 3 2 -2 2 F dxy 3.913 1 2 0 26
1647 122 1 Cr 12 3 2 -1 2 F dyz 3.913 1 2 0 27
1648 122 1 Cr 13 3 2 0 2 F dz2 3.913 1 2 0 28
1649 122 1 Cr 14 3 2 1 2 F dxz 3.913 1 2 0 29
1650 122 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 2 0 30
1651 123 2 Br 1 4 0 0 1 F s 5.317 1 2 0 31
1652 123 2 Br 2 4 0 0 2 F s 3.476 1 2 0 32
1653 123 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 33
1654 123 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 34
1655 123 2 Br 5 4 1 1 1 F px 6.996 1 2 0 35
1656 123 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 36
1657 123 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 37
1658 123 2 Br 8 4 1 1 2 F px 4.032 1 2 0 38
1659 123 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 39
1660 123 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 40
1661 123 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 41
1662 123 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 42
1663 123 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 43
1664 124 2 Br 1 4 0 0 1 F s 5.317 1 2 0 44
1665 124 2 Br 2 4 0 0 2 F s 3.476 1 2 0 45
1666 124 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 46
1667 124 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 47
1668 124 2 Br 5 4 1 1 1 F px 6.996 1 2 0 48
1669 124 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 49
1670 124 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 50
1671 124 2 Br 8 4 1 1 2 F px 4.032 1 2 0 51
1672 124 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 52
1673 124 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 53
1674 124 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 54
1675 124 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 55
1676 124 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 56
1677 125 2 Br 1 4 0 0 1 F s 5.317 1 2 0 57
1678 125 2 Br 2 4 0 0 2 F s 3.476 1 2 0 58
1679 125 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 59
1680 125 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 60
1681 125 2 Br 5 4 1 1 1 F px 6.996 1 2 0 61
1682 125 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 62
1683 125 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 63
1684 125 2 Br 8 4 1 1 2 F px 4.032 1 2 0 64
1685 125 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 65
1686 125 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 66
1687 125 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 67
1688 125 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 68
1689 125 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 69
1690 126 2 Br 1 4 0 0 1 F s 5.317 1 2 0 70
1691 126 2 Br 2 4 0 0 2 F s 3.476 1 2 0 71
1692 126 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 72
1693 126 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 73
1694 126 2 Br 5 4 1 1 1 F px 6.996 1 2 0 74
1695 126 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 75
1696 126 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 76
1697 126 2 Br 8 4 1 1 2 F px 4.032 1 2 0 77
1698 126 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 78
1699 126 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 79
1700 126 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 80
1701 126 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 81
1702 126 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 82
1703 127 2 Br 1 4 0 0 1 F s 5.317 1 2 0 83
1704 127 2 Br 2 4 0 0 2 F s 3.476 1 2 0 84
1705 127 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 85
1706 127 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 86
1707 127 2 Br 5 4 1 1 1 F px 6.996 1 2 0 87
1708 127 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 88
1709 127 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 89
1710 127 2 Br 8 4 1 1 2 F px 4.032 1 2 0 90
1711 127 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 91
1712 127 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 92
1713 127 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 93
1714 127 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 94
1715 127 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 95
1716 128 2 Br 1 4 0 0 1 F s 5.317 1 2 0 96
1717 128 2 Br 2 4 0 0 2 F s 3.476 1 2 0 97
1718 128 2 Br 3 4 1 -1 1 F py 6.996 1 2 0 98
1719 128 2 Br 4 4 1 0 1 F pz 6.996 1 2 0 99
1720 128 2 Br 5 4 1 1 1 F px 6.996 1 2 0 100
1721 128 2 Br 6 4 1 -1 2 F py 4.032 1 2 0 101
1722 128 2 Br 7 4 1 0 2 F pz 4.032 1 2 0 102
1723 128 2 Br 8 4 1 1 2 F px 4.032 1 2 0 103
1724 128 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 2 0 104
1725 128 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 2 0 105
1726 128 2 Br 11 4 2 0 1 T Pdz2 6.996 1 2 0 106
1727 128 2 Br 12 4 2 1 1 T Pdxz 6.996 1 2 0 107
1728 128 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 2 0 108
1729 129 1 Cr 1 4 0 0 1 F s 9.697 2 2 0 1
1730 129 1 Cr 2 4 0 0 2 F s 8.001 2 2 0 2
1731 129 1 Cr 3 4 1 -1 1 F py 14.099 2 2 0 3
1732 129 1 Cr 4 4 1 0 1 F pz 14.099 2 2 0 4
1733 129 1 Cr 5 4 1 1 1 F px 14.099 2 2 0 5
1734 129 1 Cr 6 3 2 -2 1 F dxy 7.210 2 2 0 6
1735 129 1 Cr 7 3 2 -1 1 F dyz 7.210 2 2 0 7
1736 129 1 Cr 8 3 2 0 1 F dz2 7.210 2 2 0 8
1737 129 1 Cr 9 3 2 1 1 F dxz 7.210 2 2 0 9
1738 129 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 2 0 10
1739 129 1 Cr 11 3 2 -2 2 F dxy 3.913 2 2 0 11
1740 129 1 Cr 12 3 2 -1 2 F dyz 3.913 2 2 0 12
1741 129 1 Cr 13 3 2 0 2 F dz2 3.913 2 2 0 13
1742 129 1 Cr 14 3 2 1 2 F dxz 3.913 2 2 0 14
1743 129 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 2 0 15
1744 130 1 Cr 1 4 0 0 1 F s 9.697 2 2 0 16
1745 130 1 Cr 2 4 0 0 2 F s 8.001 2 2 0 17
1746 130 1 Cr 3 4 1 -1 1 F py 14.099 2 2 0 18
1747 130 1 Cr 4 4 1 0 1 F pz 14.099 2 2 0 19
1748 130 1 Cr 5 4 1 1 1 F px 14.099 2 2 0 20
1749 130 1 Cr 6 3 2 -2 1 F dxy 7.210 2 2 0 21
1750 130 1 Cr 7 3 2 -1 1 F dyz 7.210 2 2 0 22
1751 130 1 Cr 8 3 2 0 1 F dz2 7.210 2 2 0 23
1752 130 1 Cr 9 3 2 1 1 F dxz 7.210 2 2 0 24
1753 130 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 2 0 25
1754 130 1 Cr 11 3 2 -2 2 F dxy 3.913 2 2 0 26
1755 130 1 Cr 12 3 2 -1 2 F dyz 3.913 2 2 0 27
1756 130 1 Cr 13 3 2 0 2 F dz2 3.913 2 2 0 28
1757 130 1 Cr 14 3 2 1 2 F dxz 3.913 2 2 0 29
1758 130 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 2 0 30
1759 131 2 Br 1 4 0 0 1 F s 5.317 2 2 0 31
1760 131 2 Br 2 4 0 0 2 F s 3.476 2 2 0 32
1761 131 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 33
1762 131 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 34
1763 131 2 Br 5 4 1 1 1 F px 6.996 2 2 0 35
1764 131 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 36
1765 131 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 37
1766 131 2 Br 8 4 1 1 2 F px 4.032 2 2 0 38
1767 131 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 39
1768 131 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 40
1769 131 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 41
1770 131 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 42
1771 131 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 43
1772 132 2 Br 1 4 0 0 1 F s 5.317 2 2 0 44
1773 132 2 Br 2 4 0 0 2 F s 3.476 2 2 0 45
1774 132 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 46
1775 132 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 47
1776 132 2 Br 5 4 1 1 1 F px 6.996 2 2 0 48
1777 132 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 49
1778 132 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 50
1779 132 2 Br 8 4 1 1 2 F px 4.032 2 2 0 51
1780 132 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 52
1781 132 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 53
1782 132 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 54
1783 132 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 55
1784 132 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 56
1785 133 2 Br 1 4 0 0 1 F s 5.317 2 2 0 57
1786 133 2 Br 2 4 0 0 2 F s 3.476 2 2 0 58
1787 133 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 59
1788 133 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 60
1789 133 2 Br 5 4 1 1 1 F px 6.996 2 2 0 61
1790 133 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 62
1791 133 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 63
1792 133 2 Br 8 4 1 1 2 F px 4.032 2 2 0 64
1793 133 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 65
1794 133 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 66
1795 133 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 67
1796 133 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 68
1797 133 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 69
1798 134 2 Br 1 4 0 0 1 F s 5.317 2 2 0 70
1799 134 2 Br 2 4 0 0 2 F s 3.476 2 2 0 71
1800 134 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 72
1801 134 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 73
1802 134 2 Br 5 4 1 1 1 F px 6.996 2 2 0 74
1803 134 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 75
1804 134 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 76
1805 134 2 Br 8 4 1 1 2 F px 4.032 2 2 0 77
1806 134 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 78
1807 134 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 79
1808 134 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 80
1809 134 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 81
1810 134 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 82
1811 135 2 Br 1 4 0 0 1 F s 5.317 2 2 0 83
1812 135 2 Br 2 4 0 0 2 F s 3.476 2 2 0 84
1813 135 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 85
1814 135 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 86
1815 135 2 Br 5 4 1 1 1 F px 6.996 2 2 0 87
1816 135 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 88
1817 135 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 89
1818 135 2 Br 8 4 1 1 2 F px 4.032 2 2 0 90
1819 135 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 91
1820 135 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 92
1821 135 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 93
1822 135 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 94
1823 135 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 95
1824 136 2 Br 1 4 0 0 1 F s 5.317 2 2 0 96
1825 136 2 Br 2 4 0 0 2 F s 3.476 2 2 0 97
1826 136 2 Br 3 4 1 -1 1 F py 6.996 2 2 0 98
1827 136 2 Br 4 4 1 0 1 F pz 6.996 2 2 0 99
1828 136 2 Br 5 4 1 1 1 F px 6.996 2 2 0 100
1829 136 2 Br 6 4 1 -1 2 F py 4.032 2 2 0 101
1830 136 2 Br 7 4 1 0 2 F pz 4.032 2 2 0 102
1831 136 2 Br 8 4 1 1 2 F px 4.032 2 2 0 103
1832 136 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 2 0 104
1833 136 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 2 0 105
1834 136 2 Br 11 4 2 0 1 T Pdz2 6.996 2 2 0 106
1835 136 2 Br 12 4 2 1 1 T Pdxz 6.996 2 2 0 107
1836 136 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 2 0 108
1837 137 1 Cr 1 4 0 0 1 F s 9.697 3 2 0 1
1838 137 1 Cr 2 4 0 0 2 F s 8.001 3 2 0 2
1839 137 1 Cr 3 4 1 -1 1 F py 14.099 3 2 0 3
1840 137 1 Cr 4 4 1 0 1 F pz 14.099 3 2 0 4
1841 137 1 Cr 5 4 1 1 1 F px 14.099 3 2 0 5
1842 137 1 Cr 6 3 2 -2 1 F dxy 7.210 3 2 0 6
1843 137 1 Cr 7 3 2 -1 1 F dyz 7.210 3 2 0 7
1844 137 1 Cr 8 3 2 0 1 F dz2 7.210 3 2 0 8
1845 137 1 Cr 9 3 2 1 1 F dxz 7.210 3 2 0 9
1846 137 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 2 0 10
1847 137 1 Cr 11 3 2 -2 2 F dxy 3.913 3 2 0 11
1848 137 1 Cr 12 3 2 -1 2 F dyz 3.913 3 2 0 12
1849 137 1 Cr 13 3 2 0 2 F dz2 3.913 3 2 0 13
1850 137 1 Cr 14 3 2 1 2 F dxz 3.913 3 2 0 14
1851 137 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 2 0 15
1852 138 1 Cr 1 4 0 0 1 F s 9.697 3 2 0 16
1853 138 1 Cr 2 4 0 0 2 F s 8.001 3 2 0 17
1854 138 1 Cr 3 4 1 -1 1 F py 14.099 3 2 0 18
1855 138 1 Cr 4 4 1 0 1 F pz 14.099 3 2 0 19
1856 138 1 Cr 5 4 1 1 1 F px 14.099 3 2 0 20
1857 138 1 Cr 6 3 2 -2 1 F dxy 7.210 3 2 0 21
1858 138 1 Cr 7 3 2 -1 1 F dyz 7.210 3 2 0 22
1859 138 1 Cr 8 3 2 0 1 F dz2 7.210 3 2 0 23
1860 138 1 Cr 9 3 2 1 1 F dxz 7.210 3 2 0 24
1861 138 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 2 0 25
1862 138 1 Cr 11 3 2 -2 2 F dxy 3.913 3 2 0 26
1863 138 1 Cr 12 3 2 -1 2 F dyz 3.913 3 2 0 27
1864 138 1 Cr 13 3 2 0 2 F dz2 3.913 3 2 0 28
1865 138 1 Cr 14 3 2 1 2 F dxz 3.913 3 2 0 29
1866 138 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 2 0 30
1867 139 2 Br 1 4 0 0 1 F s 5.317 3 2 0 31
1868 139 2 Br 2 4 0 0 2 F s 3.476 3 2 0 32
1869 139 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 33
1870 139 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 34
1871 139 2 Br 5 4 1 1 1 F px 6.996 3 2 0 35
1872 139 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 36
1873 139 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 37
1874 139 2 Br 8 4 1 1 2 F px 4.032 3 2 0 38
1875 139 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 39
1876 139 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 40
1877 139 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 41
1878 139 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 42
1879 139 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 43
1880 140 2 Br 1 4 0 0 1 F s 5.317 3 2 0 44
1881 140 2 Br 2 4 0 0 2 F s 3.476 3 2 0 45
1882 140 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 46
1883 140 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 47
1884 140 2 Br 5 4 1 1 1 F px 6.996 3 2 0 48
1885 140 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 49
1886 140 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 50
1887 140 2 Br 8 4 1 1 2 F px 4.032 3 2 0 51
1888 140 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 52
1889 140 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 53
1890 140 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 54
1891 140 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 55
1892 140 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 56
1893 141 2 Br 1 4 0 0 1 F s 5.317 3 2 0 57
1894 141 2 Br 2 4 0 0 2 F s 3.476 3 2 0 58
1895 141 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 59
1896 141 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 60
1897 141 2 Br 5 4 1 1 1 F px 6.996 3 2 0 61
1898 141 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 62
1899 141 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 63
1900 141 2 Br 8 4 1 1 2 F px 4.032 3 2 0 64
1901 141 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 65
1902 141 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 66
1903 141 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 67
1904 141 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 68
1905 141 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 69
1906 142 2 Br 1 4 0 0 1 F s 5.317 3 2 0 70
1907 142 2 Br 2 4 0 0 2 F s 3.476 3 2 0 71
1908 142 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 72
1909 142 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 73
1910 142 2 Br 5 4 1 1 1 F px 6.996 3 2 0 74
1911 142 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 75
1912 142 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 76
1913 142 2 Br 8 4 1 1 2 F px 4.032 3 2 0 77
1914 142 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 78
1915 142 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 79
1916 142 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 80
1917 142 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 81
1918 142 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 82
1919 143 2 Br 1 4 0 0 1 F s 5.317 3 2 0 83
1920 143 2 Br 2 4 0 0 2 F s 3.476 3 2 0 84
1921 143 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 85
1922 143 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 86
1923 143 2 Br 5 4 1 1 1 F px 6.996 3 2 0 87
1924 143 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 88
1925 143 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 89
1926 143 2 Br 8 4 1 1 2 F px 4.032 3 2 0 90
1927 143 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 91
1928 143 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 92
1929 143 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 93
1930 143 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 94
1931 143 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 95
1932 144 2 Br 1 4 0 0 1 F s 5.317 3 2 0 96
1933 144 2 Br 2 4 0 0 2 F s 3.476 3 2 0 97
1934 144 2 Br 3 4 1 -1 1 F py 6.996 3 2 0 98
1935 144 2 Br 4 4 1 0 1 F pz 6.996 3 2 0 99
1936 144 2 Br 5 4 1 1 1 F px 6.996 3 2 0 100
1937 144 2 Br 6 4 1 -1 2 F py 4.032 3 2 0 101
1938 144 2 Br 7 4 1 0 2 F pz 4.032 3 2 0 102
1939 144 2 Br 8 4 1 1 2 F px 4.032 3 2 0 103
1940 144 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 2 0 104
1941 144 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 2 0 105
1942 144 2 Br 11 4 2 0 1 T Pdz2 6.996 3 2 0 106
1943 144 2 Br 12 4 2 1 1 T Pdxz 6.996 3 2 0 107
1944 144 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 2 0 108
1945 145 1 Cr 1 4 0 0 1 F s 9.697 -3 2 0 1
1946 145 1 Cr 2 4 0 0 2 F s 8.001 -3 2 0 2
1947 145 1 Cr 3 4 1 -1 1 F py 14.099 -3 2 0 3
1948 145 1 Cr 4 4 1 0 1 F pz 14.099 -3 2 0 4
1949 145 1 Cr 5 4 1 1 1 F px 14.099 -3 2 0 5
1950 145 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 2 0 6
1951 145 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 2 0 7
1952 145 1 Cr 8 3 2 0 1 F dz2 7.210 -3 2 0 8
1953 145 1 Cr 9 3 2 1 1 F dxz 7.210 -3 2 0 9
1954 145 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 2 0 10
1955 145 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 2 0 11
1956 145 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 2 0 12
1957 145 1 Cr 13 3 2 0 2 F dz2 3.913 -3 2 0 13
1958 145 1 Cr 14 3 2 1 2 F dxz 3.913 -3 2 0 14
1959 145 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 2 0 15
1960 146 1 Cr 1 4 0 0 1 F s 9.697 -3 2 0 16
1961 146 1 Cr 2 4 0 0 2 F s 8.001 -3 2 0 17
1962 146 1 Cr 3 4 1 -1 1 F py 14.099 -3 2 0 18
1963 146 1 Cr 4 4 1 0 1 F pz 14.099 -3 2 0 19
1964 146 1 Cr 5 4 1 1 1 F px 14.099 -3 2 0 20
1965 146 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 2 0 21
1966 146 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 2 0 22
1967 146 1 Cr 8 3 2 0 1 F dz2 7.210 -3 2 0 23
1968 146 1 Cr 9 3 2 1 1 F dxz 7.210 -3 2 0 24
1969 146 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 2 0 25
1970 146 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 2 0 26
1971 146 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 2 0 27
1972 146 1 Cr 13 3 2 0 2 F dz2 3.913 -3 2 0 28
1973 146 1 Cr 14 3 2 1 2 F dxz 3.913 -3 2 0 29
1974 146 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 2 0 30
1975 147 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 31
1976 147 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 32
1977 147 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 33
1978 147 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 34
1979 147 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 35
1980 147 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 36
1981 147 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 37
1982 147 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 38
1983 147 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 39
1984 147 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 40
1985 147 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 41
1986 147 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 42
1987 147 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 43
1988 148 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 44
1989 148 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 45
1990 148 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 46
1991 148 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 47
1992 148 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 48
1993 148 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 49
1994 148 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 50
1995 148 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 51
1996 148 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 52
1997 148 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 53
1998 148 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 54
1999 148 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 55
2000 148 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 56
2001 149 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 57
2002 149 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 58
2003 149 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 59
2004 149 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 60
2005 149 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 61
2006 149 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 62
2007 149 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 63
2008 149 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 64
2009 149 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 65
2010 149 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 66
2011 149 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 67
2012 149 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 68
2013 149 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 69
2014 150 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 70
2015 150 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 71
2016 150 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 72
2017 150 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 73
2018 150 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 74
2019 150 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 75
2020 150 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 76
2021 150 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 77
2022 150 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 78
2023 150 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 79
2024 150 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 80
2025 150 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 81
2026 150 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 82
2027 151 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 83
2028 151 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 84
2029 151 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 85
2030 151 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 86
2031 151 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 87
2032 151 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 88
2033 151 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 89
2034 151 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 90
2035 151 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 91
2036 151 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 92
2037 151 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 93
2038 151 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 94
2039 151 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 95
2040 152 2 Br 1 4 0 0 1 F s 5.317 -3 2 0 96
2041 152 2 Br 2 4 0 0 2 F s 3.476 -3 2 0 97
2042 152 2 Br 3 4 1 -1 1 F py 6.996 -3 2 0 98
2043 152 2 Br 4 4 1 0 1 F pz 6.996 -3 2 0 99
2044 152 2 Br 5 4 1 1 1 F px 6.996 -3 2 0 100
2045 152 2 Br 6 4 1 -1 2 F py 4.032 -3 2 0 101
2046 152 2 Br 7 4 1 0 2 F pz 4.032 -3 2 0 102
2047 152 2 Br 8 4 1 1 2 F px 4.032 -3 2 0 103
2048 152 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 2 0 104
2049 152 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 2 0 105
2050 152 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 2 0 106
2051 152 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 2 0 107
2052 152 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 2 0 108
2053 153 1 Cr 1 4 0 0 1 F s 9.697 -2 2 0 1
2054 153 1 Cr 2 4 0 0 2 F s 8.001 -2 2 0 2
2055 153 1 Cr 3 4 1 -1 1 F py 14.099 -2 2 0 3
2056 153 1 Cr 4 4 1 0 1 F pz 14.099 -2 2 0 4
2057 153 1 Cr 5 4 1 1 1 F px 14.099 -2 2 0 5
2058 153 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 2 0 6
2059 153 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 2 0 7
2060 153 1 Cr 8 3 2 0 1 F dz2 7.210 -2 2 0 8
2061 153 1 Cr 9 3 2 1 1 F dxz 7.210 -2 2 0 9
2062 153 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 2 0 10
2063 153 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 2 0 11
2064 153 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 2 0 12
2065 153 1 Cr 13 3 2 0 2 F dz2 3.913 -2 2 0 13
2066 153 1 Cr 14 3 2 1 2 F dxz 3.913 -2 2 0 14
2067 153 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 2 0 15
2068 154 1 Cr 1 4 0 0 1 F s 9.697 -2 2 0 16
2069 154 1 Cr 2 4 0 0 2 F s 8.001 -2 2 0 17
2070 154 1 Cr 3 4 1 -1 1 F py 14.099 -2 2 0 18
2071 154 1 Cr 4 4 1 0 1 F pz 14.099 -2 2 0 19
2072 154 1 Cr 5 4 1 1 1 F px 14.099 -2 2 0 20
2073 154 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 2 0 21
2074 154 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 2 0 22
2075 154 1 Cr 8 3 2 0 1 F dz2 7.210 -2 2 0 23
2076 154 1 Cr 9 3 2 1 1 F dxz 7.210 -2 2 0 24
2077 154 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 2 0 25
2078 154 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 2 0 26
2079 154 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 2 0 27
2080 154 1 Cr 13 3 2 0 2 F dz2 3.913 -2 2 0 28
2081 154 1 Cr 14 3 2 1 2 F dxz 3.913 -2 2 0 29
2082 154 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 2 0 30
2083 155 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 31
2084 155 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 32
2085 155 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 33
2086 155 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 34
2087 155 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 35
2088 155 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 36
2089 155 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 37
2090 155 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 38
2091 155 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 39
2092 155 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 40
2093 155 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 41
2094 155 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 42
2095 155 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 43
2096 156 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 44
2097 156 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 45
2098 156 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 46
2099 156 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 47
2100 156 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 48
2101 156 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 49
2102 156 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 50
2103 156 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 51
2104 156 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 52
2105 156 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 53
2106 156 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 54
2107 156 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 55
2108 156 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 56
2109 157 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 57
2110 157 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 58
2111 157 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 59
2112 157 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 60
2113 157 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 61
2114 157 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 62
2115 157 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 63
2116 157 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 64
2117 157 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 65
2118 157 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 66
2119 157 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 67
2120 157 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 68
2121 157 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 69
2122 158 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 70
2123 158 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 71
2124 158 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 72
2125 158 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 73
2126 158 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 74
2127 158 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 75
2128 158 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 76
2129 158 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 77
2130 158 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 78
2131 158 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 79
2132 158 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 80
2133 158 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 81
2134 158 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 82
2135 159 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 83
2136 159 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 84
2137 159 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 85
2138 159 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 86
2139 159 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 87
2140 159 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 88
2141 159 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 89
2142 159 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 90
2143 159 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 91
2144 159 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 92
2145 159 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 93
2146 159 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 94
2147 159 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 95
2148 160 2 Br 1 4 0 0 1 F s 5.317 -2 2 0 96
2149 160 2 Br 2 4 0 0 2 F s 3.476 -2 2 0 97
2150 160 2 Br 3 4 1 -1 1 F py 6.996 -2 2 0 98
2151 160 2 Br 4 4 1 0 1 F pz 6.996 -2 2 0 99
2152 160 2 Br 5 4 1 1 1 F px 6.996 -2 2 0 100
2153 160 2 Br 6 4 1 -1 2 F py 4.032 -2 2 0 101
2154 160 2 Br 7 4 1 0 2 F pz 4.032 -2 2 0 102
2155 160 2 Br 8 4 1 1 2 F px 4.032 -2 2 0 103
2156 160 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 2 0 104
2157 160 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 2 0 105
2158 160 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 2 0 106
2159 160 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 2 0 107
2160 160 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 2 0 108
2161 161 1 Cr 1 4 0 0 1 F s 9.697 -1 2 0 1
2162 161 1 Cr 2 4 0 0 2 F s 8.001 -1 2 0 2
2163 161 1 Cr 3 4 1 -1 1 F py 14.099 -1 2 0 3
2164 161 1 Cr 4 4 1 0 1 F pz 14.099 -1 2 0 4
2165 161 1 Cr 5 4 1 1 1 F px 14.099 -1 2 0 5
2166 161 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 2 0 6
2167 161 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 2 0 7
2168 161 1 Cr 8 3 2 0 1 F dz2 7.210 -1 2 0 8
2169 161 1 Cr 9 3 2 1 1 F dxz 7.210 -1 2 0 9
2170 161 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 2 0 10
2171 161 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 2 0 11
2172 161 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 2 0 12
2173 161 1 Cr 13 3 2 0 2 F dz2 3.913 -1 2 0 13
2174 161 1 Cr 14 3 2 1 2 F dxz 3.913 -1 2 0 14
2175 161 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 2 0 15
2176 162 1 Cr 1 4 0 0 1 F s 9.697 -1 2 0 16
2177 162 1 Cr 2 4 0 0 2 F s 8.001 -1 2 0 17
2178 162 1 Cr 3 4 1 -1 1 F py 14.099 -1 2 0 18
2179 162 1 Cr 4 4 1 0 1 F pz 14.099 -1 2 0 19
2180 162 1 Cr 5 4 1 1 1 F px 14.099 -1 2 0 20
2181 162 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 2 0 21
2182 162 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 2 0 22
2183 162 1 Cr 8 3 2 0 1 F dz2 7.210 -1 2 0 23
2184 162 1 Cr 9 3 2 1 1 F dxz 7.210 -1 2 0 24
2185 162 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 2 0 25
2186 162 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 2 0 26
2187 162 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 2 0 27
2188 162 1 Cr 13 3 2 0 2 F dz2 3.913 -1 2 0 28
2189 162 1 Cr 14 3 2 1 2 F dxz 3.913 -1 2 0 29
2190 162 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 2 0 30
2191 163 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 31
2192 163 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 32
2193 163 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 33
2194 163 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 34
2195 163 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 35
2196 163 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 36
2197 163 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 37
2198 163 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 38
2199 163 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 39
2200 163 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 40
2201 163 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 41
2202 163 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 42
2203 163 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 43
2204 164 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 44
2205 164 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 45
2206 164 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 46
2207 164 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 47
2208 164 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 48
2209 164 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 49
2210 164 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 50
2211 164 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 51
2212 164 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 52
2213 164 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 53
2214 164 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 54
2215 164 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 55
2216 164 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 56
2217 165 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 57
2218 165 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 58
2219 165 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 59
2220 165 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 60
2221 165 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 61
2222 165 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 62
2223 165 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 63
2224 165 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 64
2225 165 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 65
2226 165 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 66
2227 165 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 67
2228 165 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 68
2229 165 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 69
2230 166 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 70
2231 166 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 71
2232 166 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 72
2233 166 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 73
2234 166 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 74
2235 166 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 75
2236 166 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 76
2237 166 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 77
2238 166 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 78
2239 166 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 79
2240 166 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 80
2241 166 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 81
2242 166 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 82
2243 167 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 83
2244 167 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 84
2245 167 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 85
2246 167 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 86
2247 167 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 87
2248 167 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 88
2249 167 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 89
2250 167 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 90
2251 167 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 91
2252 167 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 92
2253 167 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 93
2254 167 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 94
2255 167 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 95
2256 168 2 Br 1 4 0 0 1 F s 5.317 -1 2 0 96
2257 168 2 Br 2 4 0 0 2 F s 3.476 -1 2 0 97
2258 168 2 Br 3 4 1 -1 1 F py 6.996 -1 2 0 98
2259 168 2 Br 4 4 1 0 1 F pz 6.996 -1 2 0 99
2260 168 2 Br 5 4 1 1 1 F px 6.996 -1 2 0 100
2261 168 2 Br 6 4 1 -1 2 F py 4.032 -1 2 0 101
2262 168 2 Br 7 4 1 0 2 F pz 4.032 -1 2 0 102
2263 168 2 Br 8 4 1 1 2 F px 4.032 -1 2 0 103
2264 168 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 2 0 104
2265 168 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 2 0 105
2266 168 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 2 0 106
2267 168 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 2 0 107
2268 168 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 2 0 108
2269 169 1 Cr 1 4 0 0 1 F s 9.697 0 3 0 1
2270 169 1 Cr 2 4 0 0 2 F s 8.001 0 3 0 2
2271 169 1 Cr 3 4 1 -1 1 F py 14.099 0 3 0 3
2272 169 1 Cr 4 4 1 0 1 F pz 14.099 0 3 0 4
2273 169 1 Cr 5 4 1 1 1 F px 14.099 0 3 0 5
2274 169 1 Cr 6 3 2 -2 1 F dxy 7.210 0 3 0 6
2275 169 1 Cr 7 3 2 -1 1 F dyz 7.210 0 3 0 7
2276 169 1 Cr 8 3 2 0 1 F dz2 7.210 0 3 0 8
2277 169 1 Cr 9 3 2 1 1 F dxz 7.210 0 3 0 9
2278 169 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 3 0 10
2279 169 1 Cr 11 3 2 -2 2 F dxy 3.913 0 3 0 11
2280 169 1 Cr 12 3 2 -1 2 F dyz 3.913 0 3 0 12
2281 169 1 Cr 13 3 2 0 2 F dz2 3.913 0 3 0 13
2282 169 1 Cr 14 3 2 1 2 F dxz 3.913 0 3 0 14
2283 169 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 3 0 15
2284 170 1 Cr 1 4 0 0 1 F s 9.697 0 3 0 16
2285 170 1 Cr 2 4 0 0 2 F s 8.001 0 3 0 17
2286 170 1 Cr 3 4 1 -1 1 F py 14.099 0 3 0 18
2287 170 1 Cr 4 4 1 0 1 F pz 14.099 0 3 0 19
2288 170 1 Cr 5 4 1 1 1 F px 14.099 0 3 0 20
2289 170 1 Cr 6 3 2 -2 1 F dxy 7.210 0 3 0 21
2290 170 1 Cr 7 3 2 -1 1 F dyz 7.210 0 3 0 22
2291 170 1 Cr 8 3 2 0 1 F dz2 7.210 0 3 0 23
2292 170 1 Cr 9 3 2 1 1 F dxz 7.210 0 3 0 24
2293 170 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 3 0 25
2294 170 1 Cr 11 3 2 -2 2 F dxy 3.913 0 3 0 26
2295 170 1 Cr 12 3 2 -1 2 F dyz 3.913 0 3 0 27
2296 170 1 Cr 13 3 2 0 2 F dz2 3.913 0 3 0 28
2297 170 1 Cr 14 3 2 1 2 F dxz 3.913 0 3 0 29
2298 170 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 3 0 30
2299 171 2 Br 1 4 0 0 1 F s 5.317 0 3 0 31
2300 171 2 Br 2 4 0 0 2 F s 3.476 0 3 0 32
2301 171 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 33
2302 171 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 34
2303 171 2 Br 5 4 1 1 1 F px 6.996 0 3 0 35
2304 171 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 36
2305 171 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 37
2306 171 2 Br 8 4 1 1 2 F px 4.032 0 3 0 38
2307 171 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 39
2308 171 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 40
2309 171 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 41
2310 171 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 42
2311 171 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 43
2312 172 2 Br 1 4 0 0 1 F s 5.317 0 3 0 44
2313 172 2 Br 2 4 0 0 2 F s 3.476 0 3 0 45
2314 172 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 46
2315 172 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 47
2316 172 2 Br 5 4 1 1 1 F px 6.996 0 3 0 48
2317 172 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 49
2318 172 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 50
2319 172 2 Br 8 4 1 1 2 F px 4.032 0 3 0 51
2320 172 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 52
2321 172 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 53
2322 172 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 54
2323 172 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 55
2324 172 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 56
2325 173 2 Br 1 4 0 0 1 F s 5.317 0 3 0 57
2326 173 2 Br 2 4 0 0 2 F s 3.476 0 3 0 58
2327 173 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 59
2328 173 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 60
2329 173 2 Br 5 4 1 1 1 F px 6.996 0 3 0 61
2330 173 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 62
2331 173 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 63
2332 173 2 Br 8 4 1 1 2 F px 4.032 0 3 0 64
2333 173 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 65
2334 173 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 66
2335 173 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 67
2336 173 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 68
2337 173 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 69
2338 174 2 Br 1 4 0 0 1 F s 5.317 0 3 0 70
2339 174 2 Br 2 4 0 0 2 F s 3.476 0 3 0 71
2340 174 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 72
2341 174 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 73
2342 174 2 Br 5 4 1 1 1 F px 6.996 0 3 0 74
2343 174 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 75
2344 174 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 76
2345 174 2 Br 8 4 1 1 2 F px 4.032 0 3 0 77
2346 174 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 78
2347 174 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 79
2348 174 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 80
2349 174 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 81
2350 174 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 82
2351 175 2 Br 1 4 0 0 1 F s 5.317 0 3 0 83
2352 175 2 Br 2 4 0 0 2 F s 3.476 0 3 0 84
2353 175 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 85
2354 175 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 86
2355 175 2 Br 5 4 1 1 1 F px 6.996 0 3 0 87
2356 175 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 88
2357 175 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 89
2358 175 2 Br 8 4 1 1 2 F px 4.032 0 3 0 90
2359 175 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 91
2360 175 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 92
2361 175 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 93
2362 175 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 94
2363 175 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 95
2364 176 2 Br 1 4 0 0 1 F s 5.317 0 3 0 96
2365 176 2 Br 2 4 0 0 2 F s 3.476 0 3 0 97
2366 176 2 Br 3 4 1 -1 1 F py 6.996 0 3 0 98
2367 176 2 Br 4 4 1 0 1 F pz 6.996 0 3 0 99
2368 176 2 Br 5 4 1 1 1 F px 6.996 0 3 0 100
2369 176 2 Br 6 4 1 -1 2 F py 4.032 0 3 0 101
2370 176 2 Br 7 4 1 0 2 F pz 4.032 0 3 0 102
2371 176 2 Br 8 4 1 1 2 F px 4.032 0 3 0 103
2372 176 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 3 0 104
2373 176 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 3 0 105
2374 176 2 Br 11 4 2 0 1 T Pdz2 6.996 0 3 0 106
2375 176 2 Br 12 4 2 1 1 T Pdxz 6.996 0 3 0 107
2376 176 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 3 0 108
2377 177 1 Cr 1 4 0 0 1 F s 9.697 1 3 0 1
2378 177 1 Cr 2 4 0 0 2 F s 8.001 1 3 0 2
2379 177 1 Cr 3 4 1 -1 1 F py 14.099 1 3 0 3
2380 177 1 Cr 4 4 1 0 1 F pz 14.099 1 3 0 4
2381 177 1 Cr 5 4 1 1 1 F px 14.099 1 3 0 5
2382 177 1 Cr 6 3 2 -2 1 F dxy 7.210 1 3 0 6
2383 177 1 Cr 7 3 2 -1 1 F dyz 7.210 1 3 0 7
2384 177 1 Cr 8 3 2 0 1 F dz2 7.210 1 3 0 8
2385 177 1 Cr 9 3 2 1 1 F dxz 7.210 1 3 0 9
2386 177 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 3 0 10
2387 177 1 Cr 11 3 2 -2 2 F dxy 3.913 1 3 0 11
2388 177 1 Cr 12 3 2 -1 2 F dyz 3.913 1 3 0 12
2389 177 1 Cr 13 3 2 0 2 F dz2 3.913 1 3 0 13
2390 177 1 Cr 14 3 2 1 2 F dxz 3.913 1 3 0 14
2391 177 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 3 0 15
2392 178 1 Cr 1 4 0 0 1 F s 9.697 1 3 0 16
2393 178 1 Cr 2 4 0 0 2 F s 8.001 1 3 0 17
2394 178 1 Cr 3 4 1 -1 1 F py 14.099 1 3 0 18
2395 178 1 Cr 4 4 1 0 1 F pz 14.099 1 3 0 19
2396 178 1 Cr 5 4 1 1 1 F px 14.099 1 3 0 20
2397 178 1 Cr 6 3 2 -2 1 F dxy 7.210 1 3 0 21
2398 178 1 Cr 7 3 2 -1 1 F dyz 7.210 1 3 0 22
2399 178 1 Cr 8 3 2 0 1 F dz2 7.210 1 3 0 23
2400 178 1 Cr 9 3 2 1 1 F dxz 7.210 1 3 0 24
2401 178 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 3 0 25
2402 178 1 Cr 11 3 2 -2 2 F dxy 3.913 1 3 0 26
2403 178 1 Cr 12 3 2 -1 2 F dyz 3.913 1 3 0 27
2404 178 1 Cr 13 3 2 0 2 F dz2 3.913 1 3 0 28
2405 178 1 Cr 14 3 2 1 2 F dxz 3.913 1 3 0 29
2406 178 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 3 0 30
2407 179 2 Br 1 4 0 0 1 F s 5.317 1 3 0 31
2408 179 2 Br 2 4 0 0 2 F s 3.476 1 3 0 32
2409 179 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 33
2410 179 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 34
2411 179 2 Br 5 4 1 1 1 F px 6.996 1 3 0 35
2412 179 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 36
2413 179 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 37
2414 179 2 Br 8 4 1 1 2 F px 4.032 1 3 0 38
2415 179 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 39
2416 179 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 40
2417 179 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 41
2418 179 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 42
2419 179 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 43
2420 180 2 Br 1 4 0 0 1 F s 5.317 1 3 0 44
2421 180 2 Br 2 4 0 0 2 F s 3.476 1 3 0 45
2422 180 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 46
2423 180 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 47
2424 180 2 Br 5 4 1 1 1 F px 6.996 1 3 0 48
2425 180 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 49
2426 180 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 50
2427 180 2 Br 8 4 1 1 2 F px 4.032 1 3 0 51
2428 180 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 52
2429 180 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 53
2430 180 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 54
2431 180 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 55
2432 180 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 56
2433 181 2 Br 1 4 0 0 1 F s 5.317 1 3 0 57
2434 181 2 Br 2 4 0 0 2 F s 3.476 1 3 0 58
2435 181 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 59
2436 181 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 60
2437 181 2 Br 5 4 1 1 1 F px 6.996 1 3 0 61
2438 181 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 62
2439 181 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 63
2440 181 2 Br 8 4 1 1 2 F px 4.032 1 3 0 64
2441 181 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 65
2442 181 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 66
2443 181 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 67
2444 181 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 68
2445 181 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 69
2446 182 2 Br 1 4 0 0 1 F s 5.317 1 3 0 70
2447 182 2 Br 2 4 0 0 2 F s 3.476 1 3 0 71
2448 182 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 72
2449 182 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 73
2450 182 2 Br 5 4 1 1 1 F px 6.996 1 3 0 74
2451 182 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 75
2452 182 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 76
2453 182 2 Br 8 4 1 1 2 F px 4.032 1 3 0 77
2454 182 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 78
2455 182 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 79
2456 182 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 80
2457 182 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 81
2458 182 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 82
2459 183 2 Br 1 4 0 0 1 F s 5.317 1 3 0 83
2460 183 2 Br 2 4 0 0 2 F s 3.476 1 3 0 84
2461 183 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 85
2462 183 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 86
2463 183 2 Br 5 4 1 1 1 F px 6.996 1 3 0 87
2464 183 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 88
2465 183 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 89
2466 183 2 Br 8 4 1 1 2 F px 4.032 1 3 0 90
2467 183 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 91
2468 183 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 92
2469 183 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 93
2470 183 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 94
2471 183 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 95
2472 184 2 Br 1 4 0 0 1 F s 5.317 1 3 0 96
2473 184 2 Br 2 4 0 0 2 F s 3.476 1 3 0 97
2474 184 2 Br 3 4 1 -1 1 F py 6.996 1 3 0 98
2475 184 2 Br 4 4 1 0 1 F pz 6.996 1 3 0 99
2476 184 2 Br 5 4 1 1 1 F px 6.996 1 3 0 100
2477 184 2 Br 6 4 1 -1 2 F py 4.032 1 3 0 101
2478 184 2 Br 7 4 1 0 2 F pz 4.032 1 3 0 102
2479 184 2 Br 8 4 1 1 2 F px 4.032 1 3 0 103
2480 184 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 3 0 104
2481 184 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 3 0 105
2482 184 2 Br 11 4 2 0 1 T Pdz2 6.996 1 3 0 106
2483 184 2 Br 12 4 2 1 1 T Pdxz 6.996 1 3 0 107
2484 184 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 3 0 108
2485 185 1 Cr 1 4 0 0 1 F s 9.697 2 3 0 1
2486 185 1 Cr 2 4 0 0 2 F s 8.001 2 3 0 2
2487 185 1 Cr 3 4 1 -1 1 F py 14.099 2 3 0 3
2488 185 1 Cr 4 4 1 0 1 F pz 14.099 2 3 0 4
2489 185 1 Cr 5 4 1 1 1 F px 14.099 2 3 0 5
2490 185 1 Cr 6 3 2 -2 1 F dxy 7.210 2 3 0 6
2491 185 1 Cr 7 3 2 -1 1 F dyz 7.210 2 3 0 7
2492 185 1 Cr 8 3 2 0 1 F dz2 7.210 2 3 0 8
2493 185 1 Cr 9 3 2 1 1 F dxz 7.210 2 3 0 9
2494 185 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 3 0 10
2495 185 1 Cr 11 3 2 -2 2 F dxy 3.913 2 3 0 11
2496 185 1 Cr 12 3 2 -1 2 F dyz 3.913 2 3 0 12
2497 185 1 Cr 13 3 2 0 2 F dz2 3.913 2 3 0 13
2498 185 1 Cr 14 3 2 1 2 F dxz 3.913 2 3 0 14
2499 185 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 3 0 15
2500 186 1 Cr 1 4 0 0 1 F s 9.697 2 3 0 16
2501 186 1 Cr 2 4 0 0 2 F s 8.001 2 3 0 17
2502 186 1 Cr 3 4 1 -1 1 F py 14.099 2 3 0 18
2503 186 1 Cr 4 4 1 0 1 F pz 14.099 2 3 0 19
2504 186 1 Cr 5 4 1 1 1 F px 14.099 2 3 0 20
2505 186 1 Cr 6 3 2 -2 1 F dxy 7.210 2 3 0 21
2506 186 1 Cr 7 3 2 -1 1 F dyz 7.210 2 3 0 22
2507 186 1 Cr 8 3 2 0 1 F dz2 7.210 2 3 0 23
2508 186 1 Cr 9 3 2 1 1 F dxz 7.210 2 3 0 24
2509 186 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 3 0 25
2510 186 1 Cr 11 3 2 -2 2 F dxy 3.913 2 3 0 26
2511 186 1 Cr 12 3 2 -1 2 F dyz 3.913 2 3 0 27
2512 186 1 Cr 13 3 2 0 2 F dz2 3.913 2 3 0 28
2513 186 1 Cr 14 3 2 1 2 F dxz 3.913 2 3 0 29
2514 186 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 3 0 30
2515 187 2 Br 1 4 0 0 1 F s 5.317 2 3 0 31
2516 187 2 Br 2 4 0 0 2 F s 3.476 2 3 0 32
2517 187 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 33
2518 187 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 34
2519 187 2 Br 5 4 1 1 1 F px 6.996 2 3 0 35
2520 187 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 36
2521 187 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 37
2522 187 2 Br 8 4 1 1 2 F px 4.032 2 3 0 38
2523 187 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 39
2524 187 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 40
2525 187 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 41
2526 187 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 42
2527 187 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 43
2528 188 2 Br 1 4 0 0 1 F s 5.317 2 3 0 44
2529 188 2 Br 2 4 0 0 2 F s 3.476 2 3 0 45
2530 188 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 46
2531 188 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 47
2532 188 2 Br 5 4 1 1 1 F px 6.996 2 3 0 48
2533 188 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 49
2534 188 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 50
2535 188 2 Br 8 4 1 1 2 F px 4.032 2 3 0 51
2536 188 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 52
2537 188 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 53
2538 188 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 54
2539 188 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 55
2540 188 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 56
2541 189 2 Br 1 4 0 0 1 F s 5.317 2 3 0 57
2542 189 2 Br 2 4 0 0 2 F s 3.476 2 3 0 58
2543 189 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 59
2544 189 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 60
2545 189 2 Br 5 4 1 1 1 F px 6.996 2 3 0 61
2546 189 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 62
2547 189 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 63
2548 189 2 Br 8 4 1 1 2 F px 4.032 2 3 0 64
2549 189 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 65
2550 189 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 66
2551 189 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 67
2552 189 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 68
2553 189 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 69
2554 190 2 Br 1 4 0 0 1 F s 5.317 2 3 0 70
2555 190 2 Br 2 4 0 0 2 F s 3.476 2 3 0 71
2556 190 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 72
2557 190 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 73
2558 190 2 Br 5 4 1 1 1 F px 6.996 2 3 0 74
2559 190 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 75
2560 190 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 76
2561 190 2 Br 8 4 1 1 2 F px 4.032 2 3 0 77
2562 190 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 78
2563 190 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 79
2564 190 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 80
2565 190 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 81
2566 190 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 82
2567 191 2 Br 1 4 0 0 1 F s 5.317 2 3 0 83
2568 191 2 Br 2 4 0 0 2 F s 3.476 2 3 0 84
2569 191 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 85
2570 191 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 86
2571 191 2 Br 5 4 1 1 1 F px 6.996 2 3 0 87
2572 191 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 88
2573 191 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 89
2574 191 2 Br 8 4 1 1 2 F px 4.032 2 3 0 90
2575 191 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 91
2576 191 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 92
2577 191 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 93
2578 191 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 94
2579 191 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 95
2580 192 2 Br 1 4 0 0 1 F s 5.317 2 3 0 96
2581 192 2 Br 2 4 0 0 2 F s 3.476 2 3 0 97
2582 192 2 Br 3 4 1 -1 1 F py 6.996 2 3 0 98
2583 192 2 Br 4 4 1 0 1 F pz 6.996 2 3 0 99
2584 192 2 Br 5 4 1 1 1 F px 6.996 2 3 0 100
2585 192 2 Br 6 4 1 -1 2 F py 4.032 2 3 0 101
2586 192 2 Br 7 4 1 0 2 F pz 4.032 2 3 0 102
2587 192 2 Br 8 4 1 1 2 F px 4.032 2 3 0 103
2588 192 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 3 0 104
2589 192 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 3 0 105
2590 192 2 Br 11 4 2 0 1 T Pdz2 6.996 2 3 0 106
2591 192 2 Br 12 4 2 1 1 T Pdxz 6.996 2 3 0 107
2592 192 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 3 0 108
2593 193 1 Cr 1 4 0 0 1 F s 9.697 3 3 0 1
2594 193 1 Cr 2 4 0 0 2 F s 8.001 3 3 0 2
2595 193 1 Cr 3 4 1 -1 1 F py 14.099 3 3 0 3
2596 193 1 Cr 4 4 1 0 1 F pz 14.099 3 3 0 4
2597 193 1 Cr 5 4 1 1 1 F px 14.099 3 3 0 5
2598 193 1 Cr 6 3 2 -2 1 F dxy 7.210 3 3 0 6
2599 193 1 Cr 7 3 2 -1 1 F dyz 7.210 3 3 0 7
2600 193 1 Cr 8 3 2 0 1 F dz2 7.210 3 3 0 8
2601 193 1 Cr 9 3 2 1 1 F dxz 7.210 3 3 0 9
2602 193 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 3 0 10
2603 193 1 Cr 11 3 2 -2 2 F dxy 3.913 3 3 0 11
2604 193 1 Cr 12 3 2 -1 2 F dyz 3.913 3 3 0 12
2605 193 1 Cr 13 3 2 0 2 F dz2 3.913 3 3 0 13
2606 193 1 Cr 14 3 2 1 2 F dxz 3.913 3 3 0 14
2607 193 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 3 0 15
2608 194 1 Cr 1 4 0 0 1 F s 9.697 3 3 0 16
2609 194 1 Cr 2 4 0 0 2 F s 8.001 3 3 0 17
2610 194 1 Cr 3 4 1 -1 1 F py 14.099 3 3 0 18
2611 194 1 Cr 4 4 1 0 1 F pz 14.099 3 3 0 19
2612 194 1 Cr 5 4 1 1 1 F px 14.099 3 3 0 20
2613 194 1 Cr 6 3 2 -2 1 F dxy 7.210 3 3 0 21
2614 194 1 Cr 7 3 2 -1 1 F dyz 7.210 3 3 0 22
2615 194 1 Cr 8 3 2 0 1 F dz2 7.210 3 3 0 23
2616 194 1 Cr 9 3 2 1 1 F dxz 7.210 3 3 0 24
2617 194 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 3 0 25
2618 194 1 Cr 11 3 2 -2 2 F dxy 3.913 3 3 0 26
2619 194 1 Cr 12 3 2 -1 2 F dyz 3.913 3 3 0 27
2620 194 1 Cr 13 3 2 0 2 F dz2 3.913 3 3 0 28
2621 194 1 Cr 14 3 2 1 2 F dxz 3.913 3 3 0 29
2622 194 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 3 0 30
2623 195 2 Br 1 4 0 0 1 F s 5.317 3 3 0 31
2624 195 2 Br 2 4 0 0 2 F s 3.476 3 3 0 32
2625 195 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 33
2626 195 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 34
2627 195 2 Br 5 4 1 1 1 F px 6.996 3 3 0 35
2628 195 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 36
2629 195 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 37
2630 195 2 Br 8 4 1 1 2 F px 4.032 3 3 0 38
2631 195 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 39
2632 195 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 40
2633 195 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 41
2634 195 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 42
2635 195 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 43
2636 196 2 Br 1 4 0 0 1 F s 5.317 3 3 0 44
2637 196 2 Br 2 4 0 0 2 F s 3.476 3 3 0 45
2638 196 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 46
2639 196 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 47
2640 196 2 Br 5 4 1 1 1 F px 6.996 3 3 0 48
2641 196 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 49
2642 196 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 50
2643 196 2 Br 8 4 1 1 2 F px 4.032 3 3 0 51
2644 196 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 52
2645 196 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 53
2646 196 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 54
2647 196 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 55
2648 196 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 56
2649 197 2 Br 1 4 0 0 1 F s 5.317 3 3 0 57
2650 197 2 Br 2 4 0 0 2 F s 3.476 3 3 0 58
2651 197 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 59
2652 197 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 60
2653 197 2 Br 5 4 1 1 1 F px 6.996 3 3 0 61
2654 197 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 62
2655 197 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 63
2656 197 2 Br 8 4 1 1 2 F px 4.032 3 3 0 64
2657 197 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 65
2658 197 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 66
2659 197 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 67
2660 197 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 68
2661 197 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 69
2662 198 2 Br 1 4 0 0 1 F s 5.317 3 3 0 70
2663 198 2 Br 2 4 0 0 2 F s 3.476 3 3 0 71
2664 198 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 72
2665 198 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 73
2666 198 2 Br 5 4 1 1 1 F px 6.996 3 3 0 74
2667 198 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 75
2668 198 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 76
2669 198 2 Br 8 4 1 1 2 F px 4.032 3 3 0 77
2670 198 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 78
2671 198 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 79
2672 198 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 80
2673 198 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 81
2674 198 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 82
2675 199 2 Br 1 4 0 0 1 F s 5.317 3 3 0 83
2676 199 2 Br 2 4 0 0 2 F s 3.476 3 3 0 84
2677 199 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 85
2678 199 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 86
2679 199 2 Br 5 4 1 1 1 F px 6.996 3 3 0 87
2680 199 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 88
2681 199 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 89
2682 199 2 Br 8 4 1 1 2 F px 4.032 3 3 0 90
2683 199 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 91
2684 199 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 92
2685 199 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 93
2686 199 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 94
2687 199 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 95
2688 200 2 Br 1 4 0 0 1 F s 5.317 3 3 0 96
2689 200 2 Br 2 4 0 0 2 F s 3.476 3 3 0 97
2690 200 2 Br 3 4 1 -1 1 F py 6.996 3 3 0 98
2691 200 2 Br 4 4 1 0 1 F pz 6.996 3 3 0 99
2692 200 2 Br 5 4 1 1 1 F px 6.996 3 3 0 100
2693 200 2 Br 6 4 1 -1 2 F py 4.032 3 3 0 101
2694 200 2 Br 7 4 1 0 2 F pz 4.032 3 3 0 102
2695 200 2 Br 8 4 1 1 2 F px 4.032 3 3 0 103
2696 200 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 3 0 104
2697 200 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 3 0 105
2698 200 2 Br 11 4 2 0 1 T Pdz2 6.996 3 3 0 106
2699 200 2 Br 12 4 2 1 1 T Pdxz 6.996 3 3 0 107
2700 200 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 3 0 108
2701 201 1 Cr 1 4 0 0 1 F s 9.697 -3 3 0 1
2702 201 1 Cr 2 4 0 0 2 F s 8.001 -3 3 0 2
2703 201 1 Cr 3 4 1 -1 1 F py 14.099 -3 3 0 3
2704 201 1 Cr 4 4 1 0 1 F pz 14.099 -3 3 0 4
2705 201 1 Cr 5 4 1 1 1 F px 14.099 -3 3 0 5
2706 201 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 3 0 6
2707 201 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 3 0 7
2708 201 1 Cr 8 3 2 0 1 F dz2 7.210 -3 3 0 8
2709 201 1 Cr 9 3 2 1 1 F dxz 7.210 -3 3 0 9
2710 201 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 3 0 10
2711 201 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 3 0 11
2712 201 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 3 0 12
2713 201 1 Cr 13 3 2 0 2 F dz2 3.913 -3 3 0 13
2714 201 1 Cr 14 3 2 1 2 F dxz 3.913 -3 3 0 14
2715 201 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 3 0 15
2716 202 1 Cr 1 4 0 0 1 F s 9.697 -3 3 0 16
2717 202 1 Cr 2 4 0 0 2 F s 8.001 -3 3 0 17
2718 202 1 Cr 3 4 1 -1 1 F py 14.099 -3 3 0 18
2719 202 1 Cr 4 4 1 0 1 F pz 14.099 -3 3 0 19
2720 202 1 Cr 5 4 1 1 1 F px 14.099 -3 3 0 20
2721 202 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 3 0 21
2722 202 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 3 0 22
2723 202 1 Cr 8 3 2 0 1 F dz2 7.210 -3 3 0 23
2724 202 1 Cr 9 3 2 1 1 F dxz 7.210 -3 3 0 24
2725 202 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 3 0 25
2726 202 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 3 0 26
2727 202 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 3 0 27
2728 202 1 Cr 13 3 2 0 2 F dz2 3.913 -3 3 0 28
2729 202 1 Cr 14 3 2 1 2 F dxz 3.913 -3 3 0 29
2730 202 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 3 0 30
2731 203 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 31
2732 203 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 32
2733 203 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 33
2734 203 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 34
2735 203 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 35
2736 203 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 36
2737 203 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 37
2738 203 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 38
2739 203 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 39
2740 203 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 40
2741 203 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 41
2742 203 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 42
2743 203 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 43
2744 204 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 44
2745 204 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 45
2746 204 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 46
2747 204 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 47
2748 204 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 48
2749 204 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 49
2750 204 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 50
2751 204 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 51
2752 204 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 52
2753 204 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 53
2754 204 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 54
2755 204 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 55
2756 204 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 56
2757 205 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 57
2758 205 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 58
2759 205 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 59
2760 205 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 60
2761 205 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 61
2762 205 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 62
2763 205 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 63
2764 205 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 64
2765 205 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 65
2766 205 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 66
2767 205 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 67
2768 205 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 68
2769 205 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 69
2770 206 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 70
2771 206 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 71
2772 206 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 72
2773 206 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 73
2774 206 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 74
2775 206 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 75
2776 206 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 76
2777 206 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 77
2778 206 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 78
2779 206 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 79
2780 206 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 80
2781 206 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 81
2782 206 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 82
2783 207 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 83
2784 207 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 84
2785 207 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 85
2786 207 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 86
2787 207 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 87
2788 207 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 88
2789 207 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 89
2790 207 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 90
2791 207 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 91
2792 207 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 92
2793 207 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 93
2794 207 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 94
2795 207 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 95
2796 208 2 Br 1 4 0 0 1 F s 5.317 -3 3 0 96
2797 208 2 Br 2 4 0 0 2 F s 3.476 -3 3 0 97
2798 208 2 Br 3 4 1 -1 1 F py 6.996 -3 3 0 98
2799 208 2 Br 4 4 1 0 1 F pz 6.996 -3 3 0 99
2800 208 2 Br 5 4 1 1 1 F px 6.996 -3 3 0 100
2801 208 2 Br 6 4 1 -1 2 F py 4.032 -3 3 0 101
2802 208 2 Br 7 4 1 0 2 F pz 4.032 -3 3 0 102
2803 208 2 Br 8 4 1 1 2 F px 4.032 -3 3 0 103
2804 208 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 3 0 104
2805 208 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 3 0 105
2806 208 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 3 0 106
2807 208 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 3 0 107
2808 208 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 3 0 108
2809 209 1 Cr 1 4 0 0 1 F s 9.697 -2 3 0 1
2810 209 1 Cr 2 4 0 0 2 F s 8.001 -2 3 0 2
2811 209 1 Cr 3 4 1 -1 1 F py 14.099 -2 3 0 3
2812 209 1 Cr 4 4 1 0 1 F pz 14.099 -2 3 0 4
2813 209 1 Cr 5 4 1 1 1 F px 14.099 -2 3 0 5
2814 209 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 3 0 6
2815 209 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 3 0 7
2816 209 1 Cr 8 3 2 0 1 F dz2 7.210 -2 3 0 8
2817 209 1 Cr 9 3 2 1 1 F dxz 7.210 -2 3 0 9
2818 209 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 3 0 10
2819 209 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 3 0 11
2820 209 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 3 0 12
2821 209 1 Cr 13 3 2 0 2 F dz2 3.913 -2 3 0 13
2822 209 1 Cr 14 3 2 1 2 F dxz 3.913 -2 3 0 14
2823 209 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 3 0 15
2824 210 1 Cr 1 4 0 0 1 F s 9.697 -2 3 0 16
2825 210 1 Cr 2 4 0 0 2 F s 8.001 -2 3 0 17
2826 210 1 Cr 3 4 1 -1 1 F py 14.099 -2 3 0 18
2827 210 1 Cr 4 4 1 0 1 F pz 14.099 -2 3 0 19
2828 210 1 Cr 5 4 1 1 1 F px 14.099 -2 3 0 20
2829 210 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 3 0 21
2830 210 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 3 0 22
2831 210 1 Cr 8 3 2 0 1 F dz2 7.210 -2 3 0 23
2832 210 1 Cr 9 3 2 1 1 F dxz 7.210 -2 3 0 24
2833 210 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 3 0 25
2834 210 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 3 0 26
2835 210 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 3 0 27
2836 210 1 Cr 13 3 2 0 2 F dz2 3.913 -2 3 0 28
2837 210 1 Cr 14 3 2 1 2 F dxz 3.913 -2 3 0 29
2838 210 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 3 0 30
2839 211 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 31
2840 211 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 32
2841 211 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 33
2842 211 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 34
2843 211 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 35
2844 211 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 36
2845 211 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 37
2846 211 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 38
2847 211 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 39
2848 211 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 40
2849 211 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 41
2850 211 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 42
2851 211 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 43
2852 212 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 44
2853 212 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 45
2854 212 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 46
2855 212 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 47
2856 212 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 48
2857 212 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 49
2858 212 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 50
2859 212 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 51
2860 212 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 52
2861 212 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 53
2862 212 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 54
2863 212 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 55
2864 212 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 56
2865 213 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 57
2866 213 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 58
2867 213 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 59
2868 213 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 60
2869 213 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 61
2870 213 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 62
2871 213 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 63
2872 213 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 64
2873 213 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 65
2874 213 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 66
2875 213 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 67
2876 213 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 68
2877 213 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 69
2878 214 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 70
2879 214 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 71
2880 214 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 72
2881 214 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 73
2882 214 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 74
2883 214 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 75
2884 214 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 76
2885 214 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 77
2886 214 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 78
2887 214 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 79
2888 214 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 80
2889 214 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 81
2890 214 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 82
2891 215 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 83
2892 215 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 84
2893 215 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 85
2894 215 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 86
2895 215 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 87
2896 215 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 88
2897 215 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 89
2898 215 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 90
2899 215 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 91
2900 215 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 92
2901 215 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 93
2902 215 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 94
2903 215 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 95
2904 216 2 Br 1 4 0 0 1 F s 5.317 -2 3 0 96
2905 216 2 Br 2 4 0 0 2 F s 3.476 -2 3 0 97
2906 216 2 Br 3 4 1 -1 1 F py 6.996 -2 3 0 98
2907 216 2 Br 4 4 1 0 1 F pz 6.996 -2 3 0 99
2908 216 2 Br 5 4 1 1 1 F px 6.996 -2 3 0 100
2909 216 2 Br 6 4 1 -1 2 F py 4.032 -2 3 0 101
2910 216 2 Br 7 4 1 0 2 F pz 4.032 -2 3 0 102
2911 216 2 Br 8 4 1 1 2 F px 4.032 -2 3 0 103
2912 216 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 3 0 104
2913 216 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 3 0 105
2914 216 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 3 0 106
2915 216 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 3 0 107
2916 216 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 3 0 108
2917 217 1 Cr 1 4 0 0 1 F s 9.697 -1 3 0 1
2918 217 1 Cr 2 4 0 0 2 F s 8.001 -1 3 0 2
2919 217 1 Cr 3 4 1 -1 1 F py 14.099 -1 3 0 3
2920 217 1 Cr 4 4 1 0 1 F pz 14.099 -1 3 0 4
2921 217 1 Cr 5 4 1 1 1 F px 14.099 -1 3 0 5
2922 217 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 3 0 6
2923 217 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 3 0 7
2924 217 1 Cr 8 3 2 0 1 F dz2 7.210 -1 3 0 8
2925 217 1 Cr 9 3 2 1 1 F dxz 7.210 -1 3 0 9
2926 217 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 3 0 10
2927 217 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 3 0 11
2928 217 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 3 0 12
2929 217 1 Cr 13 3 2 0 2 F dz2 3.913 -1 3 0 13
2930 217 1 Cr 14 3 2 1 2 F dxz 3.913 -1 3 0 14
2931 217 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 3 0 15
2932 218 1 Cr 1 4 0 0 1 F s 9.697 -1 3 0 16
2933 218 1 Cr 2 4 0 0 2 F s 8.001 -1 3 0 17
2934 218 1 Cr 3 4 1 -1 1 F py 14.099 -1 3 0 18
2935 218 1 Cr 4 4 1 0 1 F pz 14.099 -1 3 0 19
2936 218 1 Cr 5 4 1 1 1 F px 14.099 -1 3 0 20
2937 218 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 3 0 21
2938 218 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 3 0 22
2939 218 1 Cr 8 3 2 0 1 F dz2 7.210 -1 3 0 23
2940 218 1 Cr 9 3 2 1 1 F dxz 7.210 -1 3 0 24
2941 218 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 3 0 25
2942 218 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 3 0 26
2943 218 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 3 0 27
2944 218 1 Cr 13 3 2 0 2 F dz2 3.913 -1 3 0 28
2945 218 1 Cr 14 3 2 1 2 F dxz 3.913 -1 3 0 29
2946 218 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 3 0 30
2947 219 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 31
2948 219 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 32
2949 219 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 33
2950 219 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 34
2951 219 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 35
2952 219 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 36
2953 219 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 37
2954 219 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 38
2955 219 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 39
2956 219 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 40
2957 219 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 41
2958 219 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 42
2959 219 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 43
2960 220 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 44
2961 220 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 45
2962 220 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 46
2963 220 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 47
2964 220 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 48
2965 220 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 49
2966 220 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 50
2967 220 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 51
2968 220 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 52
2969 220 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 53
2970 220 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 54
2971 220 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 55
2972 220 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 56
2973 221 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 57
2974 221 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 58
2975 221 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 59
2976 221 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 60
2977 221 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 61
2978 221 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 62
2979 221 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 63
2980 221 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 64
2981 221 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 65
2982 221 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 66
2983 221 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 67
2984 221 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 68
2985 221 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 69
2986 222 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 70
2987 222 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 71
2988 222 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 72
2989 222 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 73
2990 222 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 74
2991 222 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 75
2992 222 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 76
2993 222 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 77
2994 222 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 78
2995 222 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 79
2996 222 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 80
2997 222 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 81
2998 222 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 82
2999 223 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 83
3000 223 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 84
3001 223 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 85
3002 223 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 86
3003 223 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 87
3004 223 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 88
3005 223 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 89
3006 223 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 90
3007 223 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 91
3008 223 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 92
3009 223 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 93
3010 223 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 94
3011 223 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 95
3012 224 2 Br 1 4 0 0 1 F s 5.317 -1 3 0 96
3013 224 2 Br 2 4 0 0 2 F s 3.476 -1 3 0 97
3014 224 2 Br 3 4 1 -1 1 F py 6.996 -1 3 0 98
3015 224 2 Br 4 4 1 0 1 F pz 6.996 -1 3 0 99
3016 224 2 Br 5 4 1 1 1 F px 6.996 -1 3 0 100
3017 224 2 Br 6 4 1 -1 2 F py 4.032 -1 3 0 101
3018 224 2 Br 7 4 1 0 2 F pz 4.032 -1 3 0 102
3019 224 2 Br 8 4 1 1 2 F px 4.032 -1 3 0 103
3020 224 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 3 0 104
3021 224 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 3 0 105
3022 224 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 3 0 106
3023 224 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 3 0 107
3024 224 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 3 0 108
3025 225 1 Cr 1 4 0 0 1 F s 9.697 0 -3 0 1
3026 225 1 Cr 2 4 0 0 2 F s 8.001 0 -3 0 2
3027 225 1 Cr 3 4 1 -1 1 F py 14.099 0 -3 0 3
3028 225 1 Cr 4 4 1 0 1 F pz 14.099 0 -3 0 4
3029 225 1 Cr 5 4 1 1 1 F px 14.099 0 -3 0 5
3030 225 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -3 0 6
3031 225 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -3 0 7
3032 225 1 Cr 8 3 2 0 1 F dz2 7.210 0 -3 0 8
3033 225 1 Cr 9 3 2 1 1 F dxz 7.210 0 -3 0 9
3034 225 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -3 0 10
3035 225 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -3 0 11
3036 225 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -3 0 12
3037 225 1 Cr 13 3 2 0 2 F dz2 3.913 0 -3 0 13
3038 225 1 Cr 14 3 2 1 2 F dxz 3.913 0 -3 0 14
3039 225 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -3 0 15
3040 226 1 Cr 1 4 0 0 1 F s 9.697 0 -3 0 16
3041 226 1 Cr 2 4 0 0 2 F s 8.001 0 -3 0 17
3042 226 1 Cr 3 4 1 -1 1 F py 14.099 0 -3 0 18
3043 226 1 Cr 4 4 1 0 1 F pz 14.099 0 -3 0 19
3044 226 1 Cr 5 4 1 1 1 F px 14.099 0 -3 0 20
3045 226 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -3 0 21
3046 226 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -3 0 22
3047 226 1 Cr 8 3 2 0 1 F dz2 7.210 0 -3 0 23
3048 226 1 Cr 9 3 2 1 1 F dxz 7.210 0 -3 0 24
3049 226 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -3 0 25
3050 226 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -3 0 26
3051 226 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -3 0 27
3052 226 1 Cr 13 3 2 0 2 F dz2 3.913 0 -3 0 28
3053 226 1 Cr 14 3 2 1 2 F dxz 3.913 0 -3 0 29
3054 226 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -3 0 30
3055 227 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 31
3056 227 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 32
3057 227 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 33
3058 227 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 34
3059 227 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 35
3060 227 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 36
3061 227 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 37
3062 227 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 38
3063 227 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 39
3064 227 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 40
3065 227 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 41
3066 227 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 42
3067 227 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 43
3068 228 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 44
3069 228 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 45
3070 228 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 46
3071 228 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 47
3072 228 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 48
3073 228 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 49
3074 228 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 50
3075 228 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 51
3076 228 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 52
3077 228 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 53
3078 228 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 54
3079 228 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 55
3080 228 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 56
3081 229 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 57
3082 229 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 58
3083 229 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 59
3084 229 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 60
3085 229 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 61
3086 229 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 62
3087 229 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 63
3088 229 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 64
3089 229 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 65
3090 229 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 66
3091 229 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 67
3092 229 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 68
3093 229 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 69
3094 230 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 70
3095 230 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 71
3096 230 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 72
3097 230 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 73
3098 230 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 74
3099 230 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 75
3100 230 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 76
3101 230 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 77
3102 230 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 78
3103 230 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 79
3104 230 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 80
3105 230 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 81
3106 230 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 82
3107 231 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 83
3108 231 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 84
3109 231 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 85
3110 231 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 86
3111 231 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 87
3112 231 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 88
3113 231 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 89
3114 231 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 90
3115 231 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 91
3116 231 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 92
3117 231 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 93
3118 231 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 94
3119 231 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 95
3120 232 2 Br 1 4 0 0 1 F s 5.317 0 -3 0 96
3121 232 2 Br 2 4 0 0 2 F s 3.476 0 -3 0 97
3122 232 2 Br 3 4 1 -1 1 F py 6.996 0 -3 0 98
3123 232 2 Br 4 4 1 0 1 F pz 6.996 0 -3 0 99
3124 232 2 Br 5 4 1 1 1 F px 6.996 0 -3 0 100
3125 232 2 Br 6 4 1 -1 2 F py 4.032 0 -3 0 101
3126 232 2 Br 7 4 1 0 2 F pz 4.032 0 -3 0 102
3127 232 2 Br 8 4 1 1 2 F px 4.032 0 -3 0 103
3128 232 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -3 0 104
3129 232 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -3 0 105
3130 232 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -3 0 106
3131 232 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -3 0 107
3132 232 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -3 0 108
3133 233 1 Cr 1 4 0 0 1 F s 9.697 1 -3 0 1
3134 233 1 Cr 2 4 0 0 2 F s 8.001 1 -3 0 2
3135 233 1 Cr 3 4 1 -1 1 F py 14.099 1 -3 0 3
3136 233 1 Cr 4 4 1 0 1 F pz 14.099 1 -3 0 4
3137 233 1 Cr 5 4 1 1 1 F px 14.099 1 -3 0 5
3138 233 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -3 0 6
3139 233 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -3 0 7
3140 233 1 Cr 8 3 2 0 1 F dz2 7.210 1 -3 0 8
3141 233 1 Cr 9 3 2 1 1 F dxz 7.210 1 -3 0 9
3142 233 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -3 0 10
3143 233 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -3 0 11
3144 233 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -3 0 12
3145 233 1 Cr 13 3 2 0 2 F dz2 3.913 1 -3 0 13
3146 233 1 Cr 14 3 2 1 2 F dxz 3.913 1 -3 0 14
3147 233 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -3 0 15
3148 234 1 Cr 1 4 0 0 1 F s 9.697 1 -3 0 16
3149 234 1 Cr 2 4 0 0 2 F s 8.001 1 -3 0 17
3150 234 1 Cr 3 4 1 -1 1 F py 14.099 1 -3 0 18
3151 234 1 Cr 4 4 1 0 1 F pz 14.099 1 -3 0 19
3152 234 1 Cr 5 4 1 1 1 F px 14.099 1 -3 0 20
3153 234 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -3 0 21
3154 234 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -3 0 22
3155 234 1 Cr 8 3 2 0 1 F dz2 7.210 1 -3 0 23
3156 234 1 Cr 9 3 2 1 1 F dxz 7.210 1 -3 0 24
3157 234 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -3 0 25
3158 234 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -3 0 26
3159 234 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -3 0 27
3160 234 1 Cr 13 3 2 0 2 F dz2 3.913 1 -3 0 28
3161 234 1 Cr 14 3 2 1 2 F dxz 3.913 1 -3 0 29
3162 234 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -3 0 30
3163 235 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 31
3164 235 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 32
3165 235 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 33
3166 235 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 34
3167 235 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 35
3168 235 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 36
3169 235 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 37
3170 235 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 38
3171 235 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 39
3172 235 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 40
3173 235 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 41
3174 235 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 42
3175 235 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 43
3176 236 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 44
3177 236 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 45
3178 236 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 46
3179 236 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 47
3180 236 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 48
3181 236 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 49
3182 236 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 50
3183 236 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 51
3184 236 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 52
3185 236 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 53
3186 236 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 54
3187 236 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 55
3188 236 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 56
3189 237 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 57
3190 237 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 58
3191 237 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 59
3192 237 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 60
3193 237 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 61
3194 237 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 62
3195 237 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 63
3196 237 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 64
3197 237 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 65
3198 237 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 66
3199 237 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 67
3200 237 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 68
3201 237 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 69
3202 238 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 70
3203 238 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 71
3204 238 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 72
3205 238 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 73
3206 238 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 74
3207 238 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 75
3208 238 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 76
3209 238 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 77
3210 238 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 78
3211 238 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 79
3212 238 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 80
3213 238 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 81
3214 238 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 82
3215 239 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 83
3216 239 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 84
3217 239 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 85
3218 239 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 86
3219 239 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 87
3220 239 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 88
3221 239 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 89
3222 239 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 90
3223 239 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 91
3224 239 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 92
3225 239 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 93
3226 239 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 94
3227 239 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 95
3228 240 2 Br 1 4 0 0 1 F s 5.317 1 -3 0 96
3229 240 2 Br 2 4 0 0 2 F s 3.476 1 -3 0 97
3230 240 2 Br 3 4 1 -1 1 F py 6.996 1 -3 0 98
3231 240 2 Br 4 4 1 0 1 F pz 6.996 1 -3 0 99
3232 240 2 Br 5 4 1 1 1 F px 6.996 1 -3 0 100
3233 240 2 Br 6 4 1 -1 2 F py 4.032 1 -3 0 101
3234 240 2 Br 7 4 1 0 2 F pz 4.032 1 -3 0 102
3235 240 2 Br 8 4 1 1 2 F px 4.032 1 -3 0 103
3236 240 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -3 0 104
3237 240 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -3 0 105
3238 240 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -3 0 106
3239 240 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -3 0 107
3240 240 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -3 0 108
3241 241 1 Cr 1 4 0 0 1 F s 9.697 2 -3 0 1
3242 241 1 Cr 2 4 0 0 2 F s 8.001 2 -3 0 2
3243 241 1 Cr 3 4 1 -1 1 F py 14.099 2 -3 0 3
3244 241 1 Cr 4 4 1 0 1 F pz 14.099 2 -3 0 4
3245 241 1 Cr 5 4 1 1 1 F px 14.099 2 -3 0 5
3246 241 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -3 0 6
3247 241 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -3 0 7
3248 241 1 Cr 8 3 2 0 1 F dz2 7.210 2 -3 0 8
3249 241 1 Cr 9 3 2 1 1 F dxz 7.210 2 -3 0 9
3250 241 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -3 0 10
3251 241 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -3 0 11
3252 241 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -3 0 12
3253 241 1 Cr 13 3 2 0 2 F dz2 3.913 2 -3 0 13
3254 241 1 Cr 14 3 2 1 2 F dxz 3.913 2 -3 0 14
3255 241 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -3 0 15
3256 242 1 Cr 1 4 0 0 1 F s 9.697 2 -3 0 16
3257 242 1 Cr 2 4 0 0 2 F s 8.001 2 -3 0 17
3258 242 1 Cr 3 4 1 -1 1 F py 14.099 2 -3 0 18
3259 242 1 Cr 4 4 1 0 1 F pz 14.099 2 -3 0 19
3260 242 1 Cr 5 4 1 1 1 F px 14.099 2 -3 0 20
3261 242 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -3 0 21
3262 242 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -3 0 22
3263 242 1 Cr 8 3 2 0 1 F dz2 7.210 2 -3 0 23
3264 242 1 Cr 9 3 2 1 1 F dxz 7.210 2 -3 0 24
3265 242 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -3 0 25
3266 242 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -3 0 26
3267 242 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -3 0 27
3268 242 1 Cr 13 3 2 0 2 F dz2 3.913 2 -3 0 28
3269 242 1 Cr 14 3 2 1 2 F dxz 3.913 2 -3 0 29
3270 242 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -3 0 30
3271 243 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 31
3272 243 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 32
3273 243 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 33
3274 243 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 34
3275 243 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 35
3276 243 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 36
3277 243 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 37
3278 243 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 38
3279 243 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 39
3280 243 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 40
3281 243 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 41
3282 243 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 42
3283 243 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 43
3284 244 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 44
3285 244 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 45
3286 244 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 46
3287 244 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 47
3288 244 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 48
3289 244 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 49
3290 244 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 50
3291 244 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 51
3292 244 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 52
3293 244 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 53
3294 244 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 54
3295 244 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 55
3296 244 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 56
3297 245 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 57
3298 245 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 58
3299 245 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 59
3300 245 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 60
3301 245 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 61
3302 245 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 62
3303 245 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 63
3304 245 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 64
3305 245 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 65
3306 245 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 66
3307 245 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 67
3308 245 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 68
3309 245 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 69
3310 246 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 70
3311 246 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 71
3312 246 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 72
3313 246 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 73
3314 246 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 74
3315 246 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 75
3316 246 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 76
3317 246 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 77
3318 246 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 78
3319 246 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 79
3320 246 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 80
3321 246 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 81
3322 246 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 82
3323 247 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 83
3324 247 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 84
3325 247 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 85
3326 247 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 86
3327 247 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 87
3328 247 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 88
3329 247 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 89
3330 247 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 90
3331 247 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 91
3332 247 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 92
3333 247 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 93
3334 247 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 94
3335 247 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 95
3336 248 2 Br 1 4 0 0 1 F s 5.317 2 -3 0 96
3337 248 2 Br 2 4 0 0 2 F s 3.476 2 -3 0 97
3338 248 2 Br 3 4 1 -1 1 F py 6.996 2 -3 0 98
3339 248 2 Br 4 4 1 0 1 F pz 6.996 2 -3 0 99
3340 248 2 Br 5 4 1 1 1 F px 6.996 2 -3 0 100
3341 248 2 Br 6 4 1 -1 2 F py 4.032 2 -3 0 101
3342 248 2 Br 7 4 1 0 2 F pz 4.032 2 -3 0 102
3343 248 2 Br 8 4 1 1 2 F px 4.032 2 -3 0 103
3344 248 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -3 0 104
3345 248 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -3 0 105
3346 248 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -3 0 106
3347 248 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -3 0 107
3348 248 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -3 0 108
3349 249 1 Cr 1 4 0 0 1 F s 9.697 3 -3 0 1
3350 249 1 Cr 2 4 0 0 2 F s 8.001 3 -3 0 2
3351 249 1 Cr 3 4 1 -1 1 F py 14.099 3 -3 0 3
3352 249 1 Cr 4 4 1 0 1 F pz 14.099 3 -3 0 4
3353 249 1 Cr 5 4 1 1 1 F px 14.099 3 -3 0 5
3354 249 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -3 0 6
3355 249 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -3 0 7
3356 249 1 Cr 8 3 2 0 1 F dz2 7.210 3 -3 0 8
3357 249 1 Cr 9 3 2 1 1 F dxz 7.210 3 -3 0 9
3358 249 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -3 0 10
3359 249 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -3 0 11
3360 249 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -3 0 12
3361 249 1 Cr 13 3 2 0 2 F dz2 3.913 3 -3 0 13
3362 249 1 Cr 14 3 2 1 2 F dxz 3.913 3 -3 0 14
3363 249 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -3 0 15
3364 250 1 Cr 1 4 0 0 1 F s 9.697 3 -3 0 16
3365 250 1 Cr 2 4 0 0 2 F s 8.001 3 -3 0 17
3366 250 1 Cr 3 4 1 -1 1 F py 14.099 3 -3 0 18
3367 250 1 Cr 4 4 1 0 1 F pz 14.099 3 -3 0 19
3368 250 1 Cr 5 4 1 1 1 F px 14.099 3 -3 0 20
3369 250 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -3 0 21
3370 250 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -3 0 22
3371 250 1 Cr 8 3 2 0 1 F dz2 7.210 3 -3 0 23
3372 250 1 Cr 9 3 2 1 1 F dxz 7.210 3 -3 0 24
3373 250 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -3 0 25
3374 250 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -3 0 26
3375 250 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -3 0 27
3376 250 1 Cr 13 3 2 0 2 F dz2 3.913 3 -3 0 28
3377 250 1 Cr 14 3 2 1 2 F dxz 3.913 3 -3 0 29
3378 250 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -3 0 30
3379 251 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 31
3380 251 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 32
3381 251 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 33
3382 251 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 34
3383 251 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 35
3384 251 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 36
3385 251 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 37
3386 251 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 38
3387 251 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 39
3388 251 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 40
3389 251 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 41
3390 251 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 42
3391 251 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 43
3392 252 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 44
3393 252 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 45
3394 252 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 46
3395 252 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 47
3396 252 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 48
3397 252 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 49
3398 252 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 50
3399 252 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 51
3400 252 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 52
3401 252 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 53
3402 252 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 54
3403 252 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 55
3404 252 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 56
3405 253 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 57
3406 253 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 58
3407 253 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 59
3408 253 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 60
3409 253 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 61
3410 253 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 62
3411 253 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 63
3412 253 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 64
3413 253 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 65
3414 253 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 66
3415 253 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 67
3416 253 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 68
3417 253 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 69
3418 254 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 70
3419 254 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 71
3420 254 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 72
3421 254 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 73
3422 254 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 74
3423 254 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 75
3424 254 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 76
3425 254 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 77
3426 254 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 78
3427 254 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 79
3428 254 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 80
3429 254 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 81
3430 254 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 82
3431 255 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 83
3432 255 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 84
3433 255 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 85
3434 255 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 86
3435 255 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 87
3436 255 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 88
3437 255 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 89
3438 255 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 90
3439 255 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 91
3440 255 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 92
3441 255 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 93
3442 255 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 94
3443 255 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 95
3444 256 2 Br 1 4 0 0 1 F s 5.317 3 -3 0 96
3445 256 2 Br 2 4 0 0 2 F s 3.476 3 -3 0 97
3446 256 2 Br 3 4 1 -1 1 F py 6.996 3 -3 0 98
3447 256 2 Br 4 4 1 0 1 F pz 6.996 3 -3 0 99
3448 256 2 Br 5 4 1 1 1 F px 6.996 3 -3 0 100
3449 256 2 Br 6 4 1 -1 2 F py 4.032 3 -3 0 101
3450 256 2 Br 7 4 1 0 2 F pz 4.032 3 -3 0 102
3451 256 2 Br 8 4 1 1 2 F px 4.032 3 -3 0 103
3452 256 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -3 0 104
3453 256 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -3 0 105
3454 256 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -3 0 106
3455 256 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -3 0 107
3456 256 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -3 0 108
3457 257 1 Cr 1 4 0 0 1 F s 9.697 -3 -3 0 1
3458 257 1 Cr 2 4 0 0 2 F s 8.001 -3 -3 0 2
3459 257 1 Cr 3 4 1 -1 1 F py 14.099 -3 -3 0 3
3460 257 1 Cr 4 4 1 0 1 F pz 14.099 -3 -3 0 4
3461 257 1 Cr 5 4 1 1 1 F px 14.099 -3 -3 0 5
3462 257 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -3 0 6
3463 257 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -3 0 7
3464 257 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -3 0 8
3465 257 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -3 0 9
3466 257 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -3 0 10
3467 257 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -3 0 11
3468 257 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -3 0 12
3469 257 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -3 0 13
3470 257 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -3 0 14
3471 257 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -3 0 15
3472 258 1 Cr 1 4 0 0 1 F s 9.697 -3 -3 0 16
3473 258 1 Cr 2 4 0 0 2 F s 8.001 -3 -3 0 17
3474 258 1 Cr 3 4 1 -1 1 F py 14.099 -3 -3 0 18
3475 258 1 Cr 4 4 1 0 1 F pz 14.099 -3 -3 0 19
3476 258 1 Cr 5 4 1 1 1 F px 14.099 -3 -3 0 20
3477 258 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -3 0 21
3478 258 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -3 0 22
3479 258 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -3 0 23
3480 258 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -3 0 24
3481 258 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -3 0 25
3482 258 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -3 0 26
3483 258 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -3 0 27
3484 258 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -3 0 28
3485 258 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -3 0 29
3486 258 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -3 0 30
3487 259 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 31
3488 259 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 32
3489 259 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 33
3490 259 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 34
3491 259 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 35
3492 259 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 36
3493 259 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 37
3494 259 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 38
3495 259 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 39
3496 259 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 40
3497 259 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 41
3498 259 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 42
3499 259 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 43
3500 260 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 44
3501 260 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 45
3502 260 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 46
3503 260 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 47
3504 260 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 48
3505 260 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 49
3506 260 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 50
3507 260 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 51
3508 260 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 52
3509 260 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 53
3510 260 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 54
3511 260 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 55
3512 260 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 56
3513 261 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 57
3514 261 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 58
3515 261 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 59
3516 261 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 60
3517 261 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 61
3518 261 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 62
3519 261 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 63
3520 261 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 64
3521 261 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 65
3522 261 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 66
3523 261 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 67
3524 261 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 68
3525 261 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 69
3526 262 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 70
3527 262 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 71
3528 262 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 72
3529 262 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 73
3530 262 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 74
3531 262 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 75
3532 262 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 76
3533 262 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 77
3534 262 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 78
3535 262 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 79
3536 262 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 80
3537 262 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 81
3538 262 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 82
3539 263 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 83
3540 263 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 84
3541 263 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 85
3542 263 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 86
3543 263 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 87
3544 263 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 88
3545 263 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 89
3546 263 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 90
3547 263 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 91
3548 263 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 92
3549 263 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 93
3550 263 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 94
3551 263 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 95
3552 264 2 Br 1 4 0 0 1 F s 5.317 -3 -3 0 96
3553 264 2 Br 2 4 0 0 2 F s 3.476 -3 -3 0 97
3554 264 2 Br 3 4 1 -1 1 F py 6.996 -3 -3 0 98
3555 264 2 Br 4 4 1 0 1 F pz 6.996 -3 -3 0 99
3556 264 2 Br 5 4 1 1 1 F px 6.996 -3 -3 0 100
3557 264 2 Br 6 4 1 -1 2 F py 4.032 -3 -3 0 101
3558 264 2 Br 7 4 1 0 2 F pz 4.032 -3 -3 0 102
3559 264 2 Br 8 4 1 1 2 F px 4.032 -3 -3 0 103
3560 264 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -3 0 104
3561 264 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -3 0 105
3562 264 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -3 0 106
3563 264 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -3 0 107
3564 264 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -3 0 108
3565 265 1 Cr 1 4 0 0 1 F s 9.697 -2 -3 0 1
3566 265 1 Cr 2 4 0 0 2 F s 8.001 -2 -3 0 2
3567 265 1 Cr 3 4 1 -1 1 F py 14.099 -2 -3 0 3
3568 265 1 Cr 4 4 1 0 1 F pz 14.099 -2 -3 0 4
3569 265 1 Cr 5 4 1 1 1 F px 14.099 -2 -3 0 5
3570 265 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -3 0 6
3571 265 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -3 0 7
3572 265 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -3 0 8
3573 265 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -3 0 9
3574 265 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -3 0 10
3575 265 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -3 0 11
3576 265 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -3 0 12
3577 265 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -3 0 13
3578 265 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -3 0 14
3579 265 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -3 0 15
3580 266 1 Cr 1 4 0 0 1 F s 9.697 -2 -3 0 16
3581 266 1 Cr 2 4 0 0 2 F s 8.001 -2 -3 0 17
3582 266 1 Cr 3 4 1 -1 1 F py 14.099 -2 -3 0 18
3583 266 1 Cr 4 4 1 0 1 F pz 14.099 -2 -3 0 19
3584 266 1 Cr 5 4 1 1 1 F px 14.099 -2 -3 0 20
3585 266 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -3 0 21
3586 266 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -3 0 22
3587 266 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -3 0 23
3588 266 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -3 0 24
3589 266 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -3 0 25
3590 266 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -3 0 26
3591 266 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -3 0 27
3592 266 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -3 0 28
3593 266 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -3 0 29
3594 266 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -3 0 30
3595 267 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 31
3596 267 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 32
3597 267 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 33
3598 267 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 34
3599 267 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 35
3600 267 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 36
3601 267 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 37
3602 267 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 38
3603 267 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 39
3604 267 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 40
3605 267 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 41
3606 267 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 42
3607 267 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 43
3608 268 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 44
3609 268 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 45
3610 268 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 46
3611 268 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 47
3612 268 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 48
3613 268 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 49
3614 268 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 50
3615 268 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 51
3616 268 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 52
3617 268 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 53
3618 268 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 54
3619 268 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 55
3620 268 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 56
3621 269 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 57
3622 269 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 58
3623 269 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 59
3624 269 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 60
3625 269 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 61
3626 269 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 62
3627 269 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 63
3628 269 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 64
3629 269 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 65
3630 269 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 66
3631 269 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 67
3632 269 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 68
3633 269 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 69
3634 270 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 70
3635 270 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 71
3636 270 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 72
3637 270 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 73
3638 270 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 74
3639 270 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 75
3640 270 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 76
3641 270 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 77
3642 270 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 78
3643 270 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 79
3644 270 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 80
3645 270 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 81
3646 270 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 82
3647 271 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 83
3648 271 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 84
3649 271 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 85
3650 271 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 86
3651 271 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 87
3652 271 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 88
3653 271 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 89
3654 271 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 90
3655 271 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 91
3656 271 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 92
3657 271 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 93
3658 271 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 94
3659 271 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 95
3660 272 2 Br 1 4 0 0 1 F s 5.317 -2 -3 0 96
3661 272 2 Br 2 4 0 0 2 F s 3.476 -2 -3 0 97
3662 272 2 Br 3 4 1 -1 1 F py 6.996 -2 -3 0 98
3663 272 2 Br 4 4 1 0 1 F pz 6.996 -2 -3 0 99
3664 272 2 Br 5 4 1 1 1 F px 6.996 -2 -3 0 100
3665 272 2 Br 6 4 1 -1 2 F py 4.032 -2 -3 0 101
3666 272 2 Br 7 4 1 0 2 F pz 4.032 -2 -3 0 102
3667 272 2 Br 8 4 1 1 2 F px 4.032 -2 -3 0 103
3668 272 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -3 0 104
3669 272 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -3 0 105
3670 272 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -3 0 106
3671 272 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -3 0 107
3672 272 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -3 0 108
3673 273 1 Cr 1 4 0 0 1 F s 9.697 -1 -3 0 1
3674 273 1 Cr 2 4 0 0 2 F s 8.001 -1 -3 0 2
3675 273 1 Cr 3 4 1 -1 1 F py 14.099 -1 -3 0 3
3676 273 1 Cr 4 4 1 0 1 F pz 14.099 -1 -3 0 4
3677 273 1 Cr 5 4 1 1 1 F px 14.099 -1 -3 0 5
3678 273 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -3 0 6
3679 273 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -3 0 7
3680 273 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -3 0 8
3681 273 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -3 0 9
3682 273 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -3 0 10
3683 273 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -3 0 11
3684 273 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -3 0 12
3685 273 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -3 0 13
3686 273 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -3 0 14
3687 273 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -3 0 15
3688 274 1 Cr 1 4 0 0 1 F s 9.697 -1 -3 0 16
3689 274 1 Cr 2 4 0 0 2 F s 8.001 -1 -3 0 17
3690 274 1 Cr 3 4 1 -1 1 F py 14.099 -1 -3 0 18
3691 274 1 Cr 4 4 1 0 1 F pz 14.099 -1 -3 0 19
3692 274 1 Cr 5 4 1 1 1 F px 14.099 -1 -3 0 20
3693 274 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -3 0 21
3694 274 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -3 0 22
3695 274 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -3 0 23
3696 274 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -3 0 24
3697 274 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -3 0 25
3698 274 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -3 0 26
3699 274 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -3 0 27
3700 274 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -3 0 28
3701 274 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -3 0 29
3702 274 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -3 0 30
3703 275 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 31
3704 275 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 32
3705 275 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 33
3706 275 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 34
3707 275 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 35
3708 275 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 36
3709 275 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 37
3710 275 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 38
3711 275 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 39
3712 275 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 40
3713 275 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 41
3714 275 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 42
3715 275 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 43
3716 276 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 44
3717 276 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 45
3718 276 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 46
3719 276 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 47
3720 276 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 48
3721 276 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 49
3722 276 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 50
3723 276 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 51
3724 276 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 52
3725 276 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 53
3726 276 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 54
3727 276 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 55
3728 276 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 56
3729 277 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 57
3730 277 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 58
3731 277 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 59
3732 277 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 60
3733 277 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 61
3734 277 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 62
3735 277 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 63
3736 277 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 64
3737 277 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 65
3738 277 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 66
3739 277 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 67
3740 277 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 68
3741 277 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 69
3742 278 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 70
3743 278 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 71
3744 278 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 72
3745 278 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 73
3746 278 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 74
3747 278 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 75
3748 278 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 76
3749 278 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 77
3750 278 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 78
3751 278 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 79
3752 278 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 80
3753 278 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 81
3754 278 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 82
3755 279 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 83
3756 279 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 84
3757 279 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 85
3758 279 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 86
3759 279 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 87
3760 279 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 88
3761 279 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 89
3762 279 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 90
3763 279 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 91
3764 279 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 92
3765 279 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 93
3766 279 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 94
3767 279 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 95
3768 280 2 Br 1 4 0 0 1 F s 5.317 -1 -3 0 96
3769 280 2 Br 2 4 0 0 2 F s 3.476 -1 -3 0 97
3770 280 2 Br 3 4 1 -1 1 F py 6.996 -1 -3 0 98
3771 280 2 Br 4 4 1 0 1 F pz 6.996 -1 -3 0 99
3772 280 2 Br 5 4 1 1 1 F px 6.996 -1 -3 0 100
3773 280 2 Br 6 4 1 -1 2 F py 4.032 -1 -3 0 101
3774 280 2 Br 7 4 1 0 2 F pz 4.032 -1 -3 0 102
3775 280 2 Br 8 4 1 1 2 F px 4.032 -1 -3 0 103
3776 280 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -3 0 104
3777 280 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -3 0 105
3778 280 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -3 0 106
3779 280 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -3 0 107
3780 280 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -3 0 108
3781 281 1 Cr 1 4 0 0 1 F s 9.697 0 -2 0 1
3782 281 1 Cr 2 4 0 0 2 F s 8.001 0 -2 0 2
3783 281 1 Cr 3 4 1 -1 1 F py 14.099 0 -2 0 3
3784 281 1 Cr 4 4 1 0 1 F pz 14.099 0 -2 0 4
3785 281 1 Cr 5 4 1 1 1 F px 14.099 0 -2 0 5
3786 281 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -2 0 6
3787 281 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -2 0 7
3788 281 1 Cr 8 3 2 0 1 F dz2 7.210 0 -2 0 8
3789 281 1 Cr 9 3 2 1 1 F dxz 7.210 0 -2 0 9
3790 281 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -2 0 10
3791 281 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -2 0 11
3792 281 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -2 0 12
3793 281 1 Cr 13 3 2 0 2 F dz2 3.913 0 -2 0 13
3794 281 1 Cr 14 3 2 1 2 F dxz 3.913 0 -2 0 14
3795 281 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -2 0 15
3796 282 1 Cr 1 4 0 0 1 F s 9.697 0 -2 0 16
3797 282 1 Cr 2 4 0 0 2 F s 8.001 0 -2 0 17
3798 282 1 Cr 3 4 1 -1 1 F py 14.099 0 -2 0 18
3799 282 1 Cr 4 4 1 0 1 F pz 14.099 0 -2 0 19
3800 282 1 Cr 5 4 1 1 1 F px 14.099 0 -2 0 20
3801 282 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -2 0 21
3802 282 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -2 0 22
3803 282 1 Cr 8 3 2 0 1 F dz2 7.210 0 -2 0 23
3804 282 1 Cr 9 3 2 1 1 F dxz 7.210 0 -2 0 24
3805 282 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -2 0 25
3806 282 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -2 0 26
3807 282 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -2 0 27
3808 282 1 Cr 13 3 2 0 2 F dz2 3.913 0 -2 0 28
3809 282 1 Cr 14 3 2 1 2 F dxz 3.913 0 -2 0 29
3810 282 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -2 0 30
3811 283 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 31
3812 283 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 32
3813 283 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 33
3814 283 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 34
3815 283 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 35
3816 283 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 36
3817 283 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 37
3818 283 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 38
3819 283 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 39
3820 283 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 40
3821 283 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 41
3822 283 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 42
3823 283 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 43
3824 284 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 44
3825 284 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 45
3826 284 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 46
3827 284 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 47
3828 284 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 48
3829 284 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 49
3830 284 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 50
3831 284 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 51
3832 284 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 52
3833 284 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 53
3834 284 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 54
3835 284 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 55
3836 284 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 56
3837 285 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 57
3838 285 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 58
3839 285 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 59
3840 285 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 60
3841 285 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 61
3842 285 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 62
3843 285 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 63
3844 285 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 64
3845 285 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 65
3846 285 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 66
3847 285 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 67
3848 285 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 68
3849 285 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 69
3850 286 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 70
3851 286 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 71
3852 286 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 72
3853 286 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 73
3854 286 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 74
3855 286 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 75
3856 286 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 76
3857 286 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 77
3858 286 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 78
3859 286 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 79
3860 286 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 80
3861 286 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 81
3862 286 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 82
3863 287 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 83
3864 287 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 84
3865 287 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 85
3866 287 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 86
3867 287 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 87
3868 287 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 88
3869 287 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 89
3870 287 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 90
3871 287 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 91
3872 287 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 92
3873 287 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 93
3874 287 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 94
3875 287 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 95
3876 288 2 Br 1 4 0 0 1 F s 5.317 0 -2 0 96
3877 288 2 Br 2 4 0 0 2 F s 3.476 0 -2 0 97
3878 288 2 Br 3 4 1 -1 1 F py 6.996 0 -2 0 98
3879 288 2 Br 4 4 1 0 1 F pz 6.996 0 -2 0 99
3880 288 2 Br 5 4 1 1 1 F px 6.996 0 -2 0 100
3881 288 2 Br 6 4 1 -1 2 F py 4.032 0 -2 0 101
3882 288 2 Br 7 4 1 0 2 F pz 4.032 0 -2 0 102
3883 288 2 Br 8 4 1 1 2 F px 4.032 0 -2 0 103
3884 288 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -2 0 104
3885 288 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -2 0 105
3886 288 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -2 0 106
3887 288 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -2 0 107
3888 288 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -2 0 108
3889 289 1 Cr 1 4 0 0 1 F s 9.697 1 -2 0 1
3890 289 1 Cr 2 4 0 0 2 F s 8.001 1 -2 0 2
3891 289 1 Cr 3 4 1 -1 1 F py 14.099 1 -2 0 3
3892 289 1 Cr 4 4 1 0 1 F pz 14.099 1 -2 0 4
3893 289 1 Cr 5 4 1 1 1 F px 14.099 1 -2 0 5
3894 289 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -2 0 6
3895 289 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -2 0 7
3896 289 1 Cr 8 3 2 0 1 F dz2 7.210 1 -2 0 8
3897 289 1 Cr 9 3 2 1 1 F dxz 7.210 1 -2 0 9
3898 289 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -2 0 10
3899 289 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -2 0 11
3900 289 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -2 0 12
3901 289 1 Cr 13 3 2 0 2 F dz2 3.913 1 -2 0 13
3902 289 1 Cr 14 3 2 1 2 F dxz 3.913 1 -2 0 14
3903 289 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -2 0 15
3904 290 1 Cr 1 4 0 0 1 F s 9.697 1 -2 0 16
3905 290 1 Cr 2 4 0 0 2 F s 8.001 1 -2 0 17
3906 290 1 Cr 3 4 1 -1 1 F py 14.099 1 -2 0 18
3907 290 1 Cr 4 4 1 0 1 F pz 14.099 1 -2 0 19
3908 290 1 Cr 5 4 1 1 1 F px 14.099 1 -2 0 20
3909 290 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -2 0 21
3910 290 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -2 0 22
3911 290 1 Cr 8 3 2 0 1 F dz2 7.210 1 -2 0 23
3912 290 1 Cr 9 3 2 1 1 F dxz 7.210 1 -2 0 24
3913 290 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -2 0 25
3914 290 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -2 0 26
3915 290 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -2 0 27
3916 290 1 Cr 13 3 2 0 2 F dz2 3.913 1 -2 0 28
3917 290 1 Cr 14 3 2 1 2 F dxz 3.913 1 -2 0 29
3918 290 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -2 0 30
3919 291 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 31
3920 291 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 32
3921 291 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 33
3922 291 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 34
3923 291 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 35
3924 291 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 36
3925 291 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 37
3926 291 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 38
3927 291 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 39
3928 291 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 40
3929 291 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 41
3930 291 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 42
3931 291 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 43
3932 292 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 44
3933 292 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 45
3934 292 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 46
3935 292 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 47
3936 292 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 48
3937 292 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 49
3938 292 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 50
3939 292 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 51
3940 292 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 52
3941 292 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 53
3942 292 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 54
3943 292 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 55
3944 292 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 56
3945 293 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 57
3946 293 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 58
3947 293 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 59
3948 293 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 60
3949 293 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 61
3950 293 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 62
3951 293 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 63
3952 293 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 64
3953 293 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 65
3954 293 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 66
3955 293 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 67
3956 293 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 68
3957 293 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 69
3958 294 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 70
3959 294 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 71
3960 294 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 72
3961 294 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 73
3962 294 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 74
3963 294 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 75
3964 294 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 76
3965 294 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 77
3966 294 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 78
3967 294 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 79
3968 294 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 80
3969 294 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 81
3970 294 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 82
3971 295 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 83
3972 295 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 84
3973 295 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 85
3974 295 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 86
3975 295 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 87
3976 295 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 88
3977 295 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 89
3978 295 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 90
3979 295 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 91
3980 295 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 92
3981 295 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 93
3982 295 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 94
3983 295 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 95
3984 296 2 Br 1 4 0 0 1 F s 5.317 1 -2 0 96
3985 296 2 Br 2 4 0 0 2 F s 3.476 1 -2 0 97
3986 296 2 Br 3 4 1 -1 1 F py 6.996 1 -2 0 98
3987 296 2 Br 4 4 1 0 1 F pz 6.996 1 -2 0 99
3988 296 2 Br 5 4 1 1 1 F px 6.996 1 -2 0 100
3989 296 2 Br 6 4 1 -1 2 F py 4.032 1 -2 0 101
3990 296 2 Br 7 4 1 0 2 F pz 4.032 1 -2 0 102
3991 296 2 Br 8 4 1 1 2 F px 4.032 1 -2 0 103
3992 296 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -2 0 104
3993 296 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -2 0 105
3994 296 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -2 0 106
3995 296 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -2 0 107
3996 296 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -2 0 108
3997 297 1 Cr 1 4 0 0 1 F s 9.697 2 -2 0 1
3998 297 1 Cr 2 4 0 0 2 F s 8.001 2 -2 0 2
3999 297 1 Cr 3 4 1 -1 1 F py 14.099 2 -2 0 3
4000 297 1 Cr 4 4 1 0 1 F pz 14.099 2 -2 0 4
4001 297 1 Cr 5 4 1 1 1 F px 14.099 2 -2 0 5
4002 297 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -2 0 6
4003 297 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -2 0 7
4004 297 1 Cr 8 3 2 0 1 F dz2 7.210 2 -2 0 8
4005 297 1 Cr 9 3 2 1 1 F dxz 7.210 2 -2 0 9
4006 297 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -2 0 10
4007 297 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -2 0 11
4008 297 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -2 0 12
4009 297 1 Cr 13 3 2 0 2 F dz2 3.913 2 -2 0 13
4010 297 1 Cr 14 3 2 1 2 F dxz 3.913 2 -2 0 14
4011 297 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -2 0 15
4012 298 1 Cr 1 4 0 0 1 F s 9.697 2 -2 0 16
4013 298 1 Cr 2 4 0 0 2 F s 8.001 2 -2 0 17
4014 298 1 Cr 3 4 1 -1 1 F py 14.099 2 -2 0 18
4015 298 1 Cr 4 4 1 0 1 F pz 14.099 2 -2 0 19
4016 298 1 Cr 5 4 1 1 1 F px 14.099 2 -2 0 20
4017 298 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -2 0 21
4018 298 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -2 0 22
4019 298 1 Cr 8 3 2 0 1 F dz2 7.210 2 -2 0 23
4020 298 1 Cr 9 3 2 1 1 F dxz 7.210 2 -2 0 24
4021 298 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -2 0 25
4022 298 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -2 0 26
4023 298 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -2 0 27
4024 298 1 Cr 13 3 2 0 2 F dz2 3.913 2 -2 0 28
4025 298 1 Cr 14 3 2 1 2 F dxz 3.913 2 -2 0 29
4026 298 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -2 0 30
4027 299 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 31
4028 299 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 32
4029 299 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 33
4030 299 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 34
4031 299 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 35
4032 299 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 36
4033 299 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 37
4034 299 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 38
4035 299 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 39
4036 299 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 40
4037 299 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 41
4038 299 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 42
4039 299 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 43
4040 300 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 44
4041 300 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 45
4042 300 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 46
4043 300 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 47
4044 300 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 48
4045 300 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 49
4046 300 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 50
4047 300 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 51
4048 300 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 52
4049 300 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 53
4050 300 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 54
4051 300 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 55
4052 300 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 56
4053 301 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 57
4054 301 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 58
4055 301 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 59
4056 301 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 60
4057 301 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 61
4058 301 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 62
4059 301 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 63
4060 301 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 64
4061 301 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 65
4062 301 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 66
4063 301 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 67
4064 301 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 68
4065 301 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 69
4066 302 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 70
4067 302 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 71
4068 302 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 72
4069 302 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 73
4070 302 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 74
4071 302 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 75
4072 302 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 76
4073 302 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 77
4074 302 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 78
4075 302 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 79
4076 302 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 80
4077 302 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 81
4078 302 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 82
4079 303 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 83
4080 303 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 84
4081 303 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 85
4082 303 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 86
4083 303 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 87
4084 303 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 88
4085 303 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 89
4086 303 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 90
4087 303 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 91
4088 303 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 92
4089 303 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 93
4090 303 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 94
4091 303 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 95
4092 304 2 Br 1 4 0 0 1 F s 5.317 2 -2 0 96
4093 304 2 Br 2 4 0 0 2 F s 3.476 2 -2 0 97
4094 304 2 Br 3 4 1 -1 1 F py 6.996 2 -2 0 98
4095 304 2 Br 4 4 1 0 1 F pz 6.996 2 -2 0 99
4096 304 2 Br 5 4 1 1 1 F px 6.996 2 -2 0 100
4097 304 2 Br 6 4 1 -1 2 F py 4.032 2 -2 0 101
4098 304 2 Br 7 4 1 0 2 F pz 4.032 2 -2 0 102
4099 304 2 Br 8 4 1 1 2 F px 4.032 2 -2 0 103
4100 304 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -2 0 104
4101 304 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -2 0 105
4102 304 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -2 0 106
4103 304 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -2 0 107
4104 304 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -2 0 108
4105 305 1 Cr 1 4 0 0 1 F s 9.697 3 -2 0 1
4106 305 1 Cr 2 4 0 0 2 F s 8.001 3 -2 0 2
4107 305 1 Cr 3 4 1 -1 1 F py 14.099 3 -2 0 3
4108 305 1 Cr 4 4 1 0 1 F pz 14.099 3 -2 0 4
4109 305 1 Cr 5 4 1 1 1 F px 14.099 3 -2 0 5
4110 305 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -2 0 6
4111 305 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -2 0 7
4112 305 1 Cr 8 3 2 0 1 F dz2 7.210 3 -2 0 8
4113 305 1 Cr 9 3 2 1 1 F dxz 7.210 3 -2 0 9
4114 305 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -2 0 10
4115 305 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -2 0 11
4116 305 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -2 0 12
4117 305 1 Cr 13 3 2 0 2 F dz2 3.913 3 -2 0 13
4118 305 1 Cr 14 3 2 1 2 F dxz 3.913 3 -2 0 14
4119 305 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -2 0 15
4120 306 1 Cr 1 4 0 0 1 F s 9.697 3 -2 0 16
4121 306 1 Cr 2 4 0 0 2 F s 8.001 3 -2 0 17
4122 306 1 Cr 3 4 1 -1 1 F py 14.099 3 -2 0 18
4123 306 1 Cr 4 4 1 0 1 F pz 14.099 3 -2 0 19
4124 306 1 Cr 5 4 1 1 1 F px 14.099 3 -2 0 20
4125 306 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -2 0 21
4126 306 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -2 0 22
4127 306 1 Cr 8 3 2 0 1 F dz2 7.210 3 -2 0 23
4128 306 1 Cr 9 3 2 1 1 F dxz 7.210 3 -2 0 24
4129 306 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -2 0 25
4130 306 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -2 0 26
4131 306 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -2 0 27
4132 306 1 Cr 13 3 2 0 2 F dz2 3.913 3 -2 0 28
4133 306 1 Cr 14 3 2 1 2 F dxz 3.913 3 -2 0 29
4134 306 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -2 0 30
4135 307 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 31
4136 307 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 32
4137 307 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 33
4138 307 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 34
4139 307 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 35
4140 307 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 36
4141 307 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 37
4142 307 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 38
4143 307 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 39
4144 307 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 40
4145 307 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 41
4146 307 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 42
4147 307 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 43
4148 308 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 44
4149 308 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 45
4150 308 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 46
4151 308 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 47
4152 308 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 48
4153 308 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 49
4154 308 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 50
4155 308 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 51
4156 308 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 52
4157 308 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 53
4158 308 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 54
4159 308 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 55
4160 308 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 56
4161 309 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 57
4162 309 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 58
4163 309 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 59
4164 309 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 60
4165 309 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 61
4166 309 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 62
4167 309 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 63
4168 309 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 64
4169 309 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 65
4170 309 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 66
4171 309 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 67
4172 309 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 68
4173 309 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 69
4174 310 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 70
4175 310 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 71
4176 310 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 72
4177 310 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 73
4178 310 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 74
4179 310 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 75
4180 310 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 76
4181 310 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 77
4182 310 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 78
4183 310 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 79
4184 310 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 80
4185 310 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 81
4186 310 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 82
4187 311 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 83
4188 311 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 84
4189 311 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 85
4190 311 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 86
4191 311 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 87
4192 311 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 88
4193 311 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 89
4194 311 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 90
4195 311 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 91
4196 311 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 92
4197 311 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 93
4198 311 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 94
4199 311 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 95
4200 312 2 Br 1 4 0 0 1 F s 5.317 3 -2 0 96
4201 312 2 Br 2 4 0 0 2 F s 3.476 3 -2 0 97
4202 312 2 Br 3 4 1 -1 1 F py 6.996 3 -2 0 98
4203 312 2 Br 4 4 1 0 1 F pz 6.996 3 -2 0 99
4204 312 2 Br 5 4 1 1 1 F px 6.996 3 -2 0 100
4205 312 2 Br 6 4 1 -1 2 F py 4.032 3 -2 0 101
4206 312 2 Br 7 4 1 0 2 F pz 4.032 3 -2 0 102
4207 312 2 Br 8 4 1 1 2 F px 4.032 3 -2 0 103
4208 312 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -2 0 104
4209 312 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -2 0 105
4210 312 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -2 0 106
4211 312 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -2 0 107
4212 312 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -2 0 108
4213 313 1 Cr 1 4 0 0 1 F s 9.697 -3 -2 0 1
4214 313 1 Cr 2 4 0 0 2 F s 8.001 -3 -2 0 2
4215 313 1 Cr 3 4 1 -1 1 F py 14.099 -3 -2 0 3
4216 313 1 Cr 4 4 1 0 1 F pz 14.099 -3 -2 0 4
4217 313 1 Cr 5 4 1 1 1 F px 14.099 -3 -2 0 5
4218 313 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -2 0 6
4219 313 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -2 0 7
4220 313 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -2 0 8
4221 313 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -2 0 9
4222 313 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -2 0 10
4223 313 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -2 0 11
4224 313 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -2 0 12
4225 313 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -2 0 13
4226 313 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -2 0 14
4227 313 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -2 0 15
4228 314 1 Cr 1 4 0 0 1 F s 9.697 -3 -2 0 16
4229 314 1 Cr 2 4 0 0 2 F s 8.001 -3 -2 0 17
4230 314 1 Cr 3 4 1 -1 1 F py 14.099 -3 -2 0 18
4231 314 1 Cr 4 4 1 0 1 F pz 14.099 -3 -2 0 19
4232 314 1 Cr 5 4 1 1 1 F px 14.099 -3 -2 0 20
4233 314 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -2 0 21
4234 314 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -2 0 22
4235 314 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -2 0 23
4236 314 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -2 0 24
4237 314 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -2 0 25
4238 314 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -2 0 26
4239 314 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -2 0 27
4240 314 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -2 0 28
4241 314 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -2 0 29
4242 314 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -2 0 30
4243 315 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 31
4244 315 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 32
4245 315 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 33
4246 315 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 34
4247 315 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 35
4248 315 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 36
4249 315 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 37
4250 315 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 38
4251 315 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 39
4252 315 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 40
4253 315 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 41
4254 315 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 42
4255 315 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 43
4256 316 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 44
4257 316 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 45
4258 316 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 46
4259 316 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 47
4260 316 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 48
4261 316 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 49
4262 316 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 50
4263 316 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 51
4264 316 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 52
4265 316 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 53
4266 316 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 54
4267 316 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 55
4268 316 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 56
4269 317 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 57
4270 317 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 58
4271 317 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 59
4272 317 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 60
4273 317 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 61
4274 317 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 62
4275 317 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 63
4276 317 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 64
4277 317 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 65
4278 317 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 66
4279 317 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 67
4280 317 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 68
4281 317 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 69
4282 318 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 70
4283 318 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 71
4284 318 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 72
4285 318 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 73
4286 318 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 74
4287 318 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 75
4288 318 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 76
4289 318 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 77
4290 318 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 78
4291 318 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 79
4292 318 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 80
4293 318 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 81
4294 318 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 82
4295 319 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 83
4296 319 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 84
4297 319 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 85
4298 319 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 86
4299 319 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 87
4300 319 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 88
4301 319 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 89
4302 319 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 90
4303 319 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 91
4304 319 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 92
4305 319 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 93
4306 319 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 94
4307 319 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 95
4308 320 2 Br 1 4 0 0 1 F s 5.317 -3 -2 0 96
4309 320 2 Br 2 4 0 0 2 F s 3.476 -3 -2 0 97
4310 320 2 Br 3 4 1 -1 1 F py 6.996 -3 -2 0 98
4311 320 2 Br 4 4 1 0 1 F pz 6.996 -3 -2 0 99
4312 320 2 Br 5 4 1 1 1 F px 6.996 -3 -2 0 100
4313 320 2 Br 6 4 1 -1 2 F py 4.032 -3 -2 0 101
4314 320 2 Br 7 4 1 0 2 F pz 4.032 -3 -2 0 102
4315 320 2 Br 8 4 1 1 2 F px 4.032 -3 -2 0 103
4316 320 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -2 0 104
4317 320 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -2 0 105
4318 320 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -2 0 106
4319 320 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -2 0 107
4320 320 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -2 0 108
4321 321 1 Cr 1 4 0 0 1 F s 9.697 -2 -2 0 1
4322 321 1 Cr 2 4 0 0 2 F s 8.001 -2 -2 0 2
4323 321 1 Cr 3 4 1 -1 1 F py 14.099 -2 -2 0 3
4324 321 1 Cr 4 4 1 0 1 F pz 14.099 -2 -2 0 4
4325 321 1 Cr 5 4 1 1 1 F px 14.099 -2 -2 0 5
4326 321 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -2 0 6
4327 321 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -2 0 7
4328 321 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -2 0 8
4329 321 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -2 0 9
4330 321 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -2 0 10
4331 321 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -2 0 11
4332 321 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -2 0 12
4333 321 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -2 0 13
4334 321 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -2 0 14
4335 321 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -2 0 15
4336 322 1 Cr 1 4 0 0 1 F s 9.697 -2 -2 0 16
4337 322 1 Cr 2 4 0 0 2 F s 8.001 -2 -2 0 17
4338 322 1 Cr 3 4 1 -1 1 F py 14.099 -2 -2 0 18
4339 322 1 Cr 4 4 1 0 1 F pz 14.099 -2 -2 0 19
4340 322 1 Cr 5 4 1 1 1 F px 14.099 -2 -2 0 20
4341 322 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -2 0 21
4342 322 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -2 0 22
4343 322 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -2 0 23
4344 322 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -2 0 24
4345 322 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -2 0 25
4346 322 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -2 0 26
4347 322 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -2 0 27
4348 322 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -2 0 28
4349 322 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -2 0 29
4350 322 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -2 0 30
4351 323 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 31
4352 323 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 32
4353 323 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 33
4354 323 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 34
4355 323 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 35
4356 323 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 36
4357 323 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 37
4358 323 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 38
4359 323 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 39
4360 323 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 40
4361 323 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 41
4362 323 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 42
4363 323 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 43
4364 324 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 44
4365 324 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 45
4366 324 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 46
4367 324 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 47
4368 324 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 48
4369 324 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 49
4370 324 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 50
4371 324 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 51
4372 324 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 52
4373 324 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 53
4374 324 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 54
4375 324 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 55
4376 324 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 56
4377 325 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 57
4378 325 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 58
4379 325 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 59
4380 325 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 60
4381 325 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 61
4382 325 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 62
4383 325 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 63
4384 325 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 64
4385 325 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 65
4386 325 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 66
4387 325 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 67
4388 325 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 68
4389 325 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 69
4390 326 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 70
4391 326 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 71
4392 326 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 72
4393 326 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 73
4394 326 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 74
4395 326 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 75
4396 326 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 76
4397 326 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 77
4398 326 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 78
4399 326 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 79
4400 326 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 80
4401 326 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 81
4402 326 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 82
4403 327 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 83
4404 327 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 84
4405 327 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 85
4406 327 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 86
4407 327 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 87
4408 327 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 88
4409 327 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 89
4410 327 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 90
4411 327 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 91
4412 327 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 92
4413 327 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 93
4414 327 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 94
4415 327 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 95
4416 328 2 Br 1 4 0 0 1 F s 5.317 -2 -2 0 96
4417 328 2 Br 2 4 0 0 2 F s 3.476 -2 -2 0 97
4418 328 2 Br 3 4 1 -1 1 F py 6.996 -2 -2 0 98
4419 328 2 Br 4 4 1 0 1 F pz 6.996 -2 -2 0 99
4420 328 2 Br 5 4 1 1 1 F px 6.996 -2 -2 0 100
4421 328 2 Br 6 4 1 -1 2 F py 4.032 -2 -2 0 101
4422 328 2 Br 7 4 1 0 2 F pz 4.032 -2 -2 0 102
4423 328 2 Br 8 4 1 1 2 F px 4.032 -2 -2 0 103
4424 328 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -2 0 104
4425 328 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -2 0 105
4426 328 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -2 0 106
4427 328 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -2 0 107
4428 328 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -2 0 108
4429 329 1 Cr 1 4 0 0 1 F s 9.697 -1 -2 0 1
4430 329 1 Cr 2 4 0 0 2 F s 8.001 -1 -2 0 2
4431 329 1 Cr 3 4 1 -1 1 F py 14.099 -1 -2 0 3
4432 329 1 Cr 4 4 1 0 1 F pz 14.099 -1 -2 0 4
4433 329 1 Cr 5 4 1 1 1 F px 14.099 -1 -2 0 5
4434 329 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -2 0 6
4435 329 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -2 0 7
4436 329 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -2 0 8
4437 329 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -2 0 9
4438 329 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -2 0 10
4439 329 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -2 0 11
4440 329 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -2 0 12
4441 329 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -2 0 13
4442 329 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -2 0 14
4443 329 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -2 0 15
4444 330 1 Cr 1 4 0 0 1 F s 9.697 -1 -2 0 16
4445 330 1 Cr 2 4 0 0 2 F s 8.001 -1 -2 0 17
4446 330 1 Cr 3 4 1 -1 1 F py 14.099 -1 -2 0 18
4447 330 1 Cr 4 4 1 0 1 F pz 14.099 -1 -2 0 19
4448 330 1 Cr 5 4 1 1 1 F px 14.099 -1 -2 0 20
4449 330 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -2 0 21
4450 330 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -2 0 22
4451 330 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -2 0 23
4452 330 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -2 0 24
4453 330 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -2 0 25
4454 330 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -2 0 26
4455 330 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -2 0 27
4456 330 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -2 0 28
4457 330 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -2 0 29
4458 330 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -2 0 30
4459 331 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 31
4460 331 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 32
4461 331 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 33
4462 331 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 34
4463 331 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 35
4464 331 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 36
4465 331 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 37
4466 331 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 38
4467 331 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 39
4468 331 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 40
4469 331 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 41
4470 331 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 42
4471 331 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 43
4472 332 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 44
4473 332 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 45
4474 332 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 46
4475 332 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 47
4476 332 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 48
4477 332 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 49
4478 332 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 50
4479 332 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 51
4480 332 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 52
4481 332 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 53
4482 332 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 54
4483 332 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 55
4484 332 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 56
4485 333 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 57
4486 333 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 58
4487 333 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 59
4488 333 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 60
4489 333 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 61
4490 333 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 62
4491 333 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 63
4492 333 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 64
4493 333 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 65
4494 333 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 66
4495 333 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 67
4496 333 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 68
4497 333 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 69
4498 334 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 70
4499 334 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 71
4500 334 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 72
4501 334 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 73
4502 334 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 74
4503 334 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 75
4504 334 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 76
4505 334 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 77
4506 334 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 78
4507 334 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 79
4508 334 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 80
4509 334 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 81
4510 334 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 82
4511 335 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 83
4512 335 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 84
4513 335 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 85
4514 335 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 86
4515 335 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 87
4516 335 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 88
4517 335 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 89
4518 335 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 90
4519 335 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 91
4520 335 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 92
4521 335 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 93
4522 335 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 94
4523 335 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 95
4524 336 2 Br 1 4 0 0 1 F s 5.317 -1 -2 0 96
4525 336 2 Br 2 4 0 0 2 F s 3.476 -1 -2 0 97
4526 336 2 Br 3 4 1 -1 1 F py 6.996 -1 -2 0 98
4527 336 2 Br 4 4 1 0 1 F pz 6.996 -1 -2 0 99
4528 336 2 Br 5 4 1 1 1 F px 6.996 -1 -2 0 100
4529 336 2 Br 6 4 1 -1 2 F py 4.032 -1 -2 0 101
4530 336 2 Br 7 4 1 0 2 F pz 4.032 -1 -2 0 102
4531 336 2 Br 8 4 1 1 2 F px 4.032 -1 -2 0 103
4532 336 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -2 0 104
4533 336 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -2 0 105
4534 336 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -2 0 106
4535 336 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -2 0 107
4536 336 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -2 0 108
4537 337 1 Cr 1 4 0 0 1 F s 9.697 0 -1 0 1
4538 337 1 Cr 2 4 0 0 2 F s 8.001 0 -1 0 2
4539 337 1 Cr 3 4 1 -1 1 F py 14.099 0 -1 0 3
4540 337 1 Cr 4 4 1 0 1 F pz 14.099 0 -1 0 4
4541 337 1 Cr 5 4 1 1 1 F px 14.099 0 -1 0 5
4542 337 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -1 0 6
4543 337 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -1 0 7
4544 337 1 Cr 8 3 2 0 1 F dz2 7.210 0 -1 0 8
4545 337 1 Cr 9 3 2 1 1 F dxz 7.210 0 -1 0 9
4546 337 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -1 0 10
4547 337 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -1 0 11
4548 337 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -1 0 12
4549 337 1 Cr 13 3 2 0 2 F dz2 3.913 0 -1 0 13
4550 337 1 Cr 14 3 2 1 2 F dxz 3.913 0 -1 0 14
4551 337 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -1 0 15
4552 338 1 Cr 1 4 0 0 1 F s 9.697 0 -1 0 16
4553 338 1 Cr 2 4 0 0 2 F s 8.001 0 -1 0 17
4554 338 1 Cr 3 4 1 -1 1 F py 14.099 0 -1 0 18
4555 338 1 Cr 4 4 1 0 1 F pz 14.099 0 -1 0 19
4556 338 1 Cr 5 4 1 1 1 F px 14.099 0 -1 0 20
4557 338 1 Cr 6 3 2 -2 1 F dxy 7.210 0 -1 0 21
4558 338 1 Cr 7 3 2 -1 1 F dyz 7.210 0 -1 0 22
4559 338 1 Cr 8 3 2 0 1 F dz2 7.210 0 -1 0 23
4560 338 1 Cr 9 3 2 1 1 F dxz 7.210 0 -1 0 24
4561 338 1 Cr 10 3 2 2 1 F dx2-y2 7.210 0 -1 0 25
4562 338 1 Cr 11 3 2 -2 2 F dxy 3.913 0 -1 0 26
4563 338 1 Cr 12 3 2 -1 2 F dyz 3.913 0 -1 0 27
4564 338 1 Cr 13 3 2 0 2 F dz2 3.913 0 -1 0 28
4565 338 1 Cr 14 3 2 1 2 F dxz 3.913 0 -1 0 29
4566 338 1 Cr 15 3 2 2 2 F dx2-y2 3.913 0 -1 0 30
4567 339 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 31
4568 339 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 32
4569 339 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 33
4570 339 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 34
4571 339 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 35
4572 339 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 36
4573 339 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 37
4574 339 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 38
4575 339 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 39
4576 339 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 40
4577 339 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 41
4578 339 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 42
4579 339 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 43
4580 340 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 44
4581 340 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 45
4582 340 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 46
4583 340 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 47
4584 340 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 48
4585 340 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 49
4586 340 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 50
4587 340 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 51
4588 340 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 52
4589 340 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 53
4590 340 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 54
4591 340 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 55
4592 340 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 56
4593 341 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 57
4594 341 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 58
4595 341 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 59
4596 341 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 60
4597 341 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 61
4598 341 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 62
4599 341 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 63
4600 341 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 64
4601 341 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 65
4602 341 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 66
4603 341 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 67
4604 341 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 68
4605 341 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 69
4606 342 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 70
4607 342 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 71
4608 342 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 72
4609 342 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 73
4610 342 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 74
4611 342 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 75
4612 342 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 76
4613 342 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 77
4614 342 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 78
4615 342 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 79
4616 342 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 80
4617 342 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 81
4618 342 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 82
4619 343 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 83
4620 343 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 84
4621 343 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 85
4622 343 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 86
4623 343 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 87
4624 343 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 88
4625 343 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 89
4626 343 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 90
4627 343 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 91
4628 343 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 92
4629 343 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 93
4630 343 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 94
4631 343 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 95
4632 344 2 Br 1 4 0 0 1 F s 5.317 0 -1 0 96
4633 344 2 Br 2 4 0 0 2 F s 3.476 0 -1 0 97
4634 344 2 Br 3 4 1 -1 1 F py 6.996 0 -1 0 98
4635 344 2 Br 4 4 1 0 1 F pz 6.996 0 -1 0 99
4636 344 2 Br 5 4 1 1 1 F px 6.996 0 -1 0 100
4637 344 2 Br 6 4 1 -1 2 F py 4.032 0 -1 0 101
4638 344 2 Br 7 4 1 0 2 F pz 4.032 0 -1 0 102
4639 344 2 Br 8 4 1 1 2 F px 4.032 0 -1 0 103
4640 344 2 Br 9 4 2 -2 1 T Pdxy 6.996 0 -1 0 104
4641 344 2 Br 10 4 2 -1 1 T Pdyz 6.996 0 -1 0 105
4642 344 2 Br 11 4 2 0 1 T Pdz2 6.996 0 -1 0 106
4643 344 2 Br 12 4 2 1 1 T Pdxz 6.996 0 -1 0 107
4644 344 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 0 -1 0 108
4645 345 1 Cr 1 4 0 0 1 F s 9.697 1 -1 0 1
4646 345 1 Cr 2 4 0 0 2 F s 8.001 1 -1 0 2
4647 345 1 Cr 3 4 1 -1 1 F py 14.099 1 -1 0 3
4648 345 1 Cr 4 4 1 0 1 F pz 14.099 1 -1 0 4
4649 345 1 Cr 5 4 1 1 1 F px 14.099 1 -1 0 5
4650 345 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -1 0 6
4651 345 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -1 0 7
4652 345 1 Cr 8 3 2 0 1 F dz2 7.210 1 -1 0 8
4653 345 1 Cr 9 3 2 1 1 F dxz 7.210 1 -1 0 9
4654 345 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -1 0 10
4655 345 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -1 0 11
4656 345 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -1 0 12
4657 345 1 Cr 13 3 2 0 2 F dz2 3.913 1 -1 0 13
4658 345 1 Cr 14 3 2 1 2 F dxz 3.913 1 -1 0 14
4659 345 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -1 0 15
4660 346 1 Cr 1 4 0 0 1 F s 9.697 1 -1 0 16
4661 346 1 Cr 2 4 0 0 2 F s 8.001 1 -1 0 17
4662 346 1 Cr 3 4 1 -1 1 F py 14.099 1 -1 0 18
4663 346 1 Cr 4 4 1 0 1 F pz 14.099 1 -1 0 19
4664 346 1 Cr 5 4 1 1 1 F px 14.099 1 -1 0 20
4665 346 1 Cr 6 3 2 -2 1 F dxy 7.210 1 -1 0 21
4666 346 1 Cr 7 3 2 -1 1 F dyz 7.210 1 -1 0 22
4667 346 1 Cr 8 3 2 0 1 F dz2 7.210 1 -1 0 23
4668 346 1 Cr 9 3 2 1 1 F dxz 7.210 1 -1 0 24
4669 346 1 Cr 10 3 2 2 1 F dx2-y2 7.210 1 -1 0 25
4670 346 1 Cr 11 3 2 -2 2 F dxy 3.913 1 -1 0 26
4671 346 1 Cr 12 3 2 -1 2 F dyz 3.913 1 -1 0 27
4672 346 1 Cr 13 3 2 0 2 F dz2 3.913 1 -1 0 28
4673 346 1 Cr 14 3 2 1 2 F dxz 3.913 1 -1 0 29
4674 346 1 Cr 15 3 2 2 2 F dx2-y2 3.913 1 -1 0 30
4675 347 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 31
4676 347 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 32
4677 347 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 33
4678 347 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 34
4679 347 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 35
4680 347 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 36
4681 347 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 37
4682 347 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 38
4683 347 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 39
4684 347 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 40
4685 347 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 41
4686 347 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 42
4687 347 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 43
4688 348 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 44
4689 348 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 45
4690 348 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 46
4691 348 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 47
4692 348 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 48
4693 348 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 49
4694 348 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 50
4695 348 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 51
4696 348 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 52
4697 348 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 53
4698 348 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 54
4699 348 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 55
4700 348 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 56
4701 349 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 57
4702 349 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 58
4703 349 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 59
4704 349 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 60
4705 349 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 61
4706 349 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 62
4707 349 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 63
4708 349 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 64
4709 349 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 65
4710 349 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 66
4711 349 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 67
4712 349 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 68
4713 349 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 69
4714 350 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 70
4715 350 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 71
4716 350 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 72
4717 350 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 73
4718 350 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 74
4719 350 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 75
4720 350 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 76
4721 350 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 77
4722 350 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 78
4723 350 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 79
4724 350 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 80
4725 350 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 81
4726 350 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 82
4727 351 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 83
4728 351 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 84
4729 351 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 85
4730 351 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 86
4731 351 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 87
4732 351 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 88
4733 351 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 89
4734 351 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 90
4735 351 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 91
4736 351 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 92
4737 351 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 93
4738 351 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 94
4739 351 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 95
4740 352 2 Br 1 4 0 0 1 F s 5.317 1 -1 0 96
4741 352 2 Br 2 4 0 0 2 F s 3.476 1 -1 0 97
4742 352 2 Br 3 4 1 -1 1 F py 6.996 1 -1 0 98
4743 352 2 Br 4 4 1 0 1 F pz 6.996 1 -1 0 99
4744 352 2 Br 5 4 1 1 1 F px 6.996 1 -1 0 100
4745 352 2 Br 6 4 1 -1 2 F py 4.032 1 -1 0 101
4746 352 2 Br 7 4 1 0 2 F pz 4.032 1 -1 0 102
4747 352 2 Br 8 4 1 1 2 F px 4.032 1 -1 0 103
4748 352 2 Br 9 4 2 -2 1 T Pdxy 6.996 1 -1 0 104
4749 352 2 Br 10 4 2 -1 1 T Pdyz 6.996 1 -1 0 105
4750 352 2 Br 11 4 2 0 1 T Pdz2 6.996 1 -1 0 106
4751 352 2 Br 12 4 2 1 1 T Pdxz 6.996 1 -1 0 107
4752 352 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 1 -1 0 108
4753 353 1 Cr 1 4 0 0 1 F s 9.697 2 -1 0 1
4754 353 1 Cr 2 4 0 0 2 F s 8.001 2 -1 0 2
4755 353 1 Cr 3 4 1 -1 1 F py 14.099 2 -1 0 3
4756 353 1 Cr 4 4 1 0 1 F pz 14.099 2 -1 0 4
4757 353 1 Cr 5 4 1 1 1 F px 14.099 2 -1 0 5
4758 353 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -1 0 6
4759 353 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -1 0 7
4760 353 1 Cr 8 3 2 0 1 F dz2 7.210 2 -1 0 8
4761 353 1 Cr 9 3 2 1 1 F dxz 7.210 2 -1 0 9
4762 353 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -1 0 10
4763 353 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -1 0 11
4764 353 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -1 0 12
4765 353 1 Cr 13 3 2 0 2 F dz2 3.913 2 -1 0 13
4766 353 1 Cr 14 3 2 1 2 F dxz 3.913 2 -1 0 14
4767 353 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -1 0 15
4768 354 1 Cr 1 4 0 0 1 F s 9.697 2 -1 0 16
4769 354 1 Cr 2 4 0 0 2 F s 8.001 2 -1 0 17
4770 354 1 Cr 3 4 1 -1 1 F py 14.099 2 -1 0 18
4771 354 1 Cr 4 4 1 0 1 F pz 14.099 2 -1 0 19
4772 354 1 Cr 5 4 1 1 1 F px 14.099 2 -1 0 20
4773 354 1 Cr 6 3 2 -2 1 F dxy 7.210 2 -1 0 21
4774 354 1 Cr 7 3 2 -1 1 F dyz 7.210 2 -1 0 22
4775 354 1 Cr 8 3 2 0 1 F dz2 7.210 2 -1 0 23
4776 354 1 Cr 9 3 2 1 1 F dxz 7.210 2 -1 0 24
4777 354 1 Cr 10 3 2 2 1 F dx2-y2 7.210 2 -1 0 25
4778 354 1 Cr 11 3 2 -2 2 F dxy 3.913 2 -1 0 26
4779 354 1 Cr 12 3 2 -1 2 F dyz 3.913 2 -1 0 27
4780 354 1 Cr 13 3 2 0 2 F dz2 3.913 2 -1 0 28
4781 354 1 Cr 14 3 2 1 2 F dxz 3.913 2 -1 0 29
4782 354 1 Cr 15 3 2 2 2 F dx2-y2 3.913 2 -1 0 30
4783 355 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 31
4784 355 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 32
4785 355 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 33
4786 355 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 34
4787 355 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 35
4788 355 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 36
4789 355 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 37
4790 355 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 38
4791 355 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 39
4792 355 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 40
4793 355 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 41
4794 355 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 42
4795 355 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 43
4796 356 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 44
4797 356 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 45
4798 356 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 46
4799 356 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 47
4800 356 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 48
4801 356 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 49
4802 356 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 50
4803 356 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 51
4804 356 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 52
4805 356 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 53
4806 356 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 54
4807 356 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 55
4808 356 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 56
4809 357 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 57
4810 357 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 58
4811 357 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 59
4812 357 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 60
4813 357 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 61
4814 357 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 62
4815 357 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 63
4816 357 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 64
4817 357 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 65
4818 357 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 66
4819 357 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 67
4820 357 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 68
4821 357 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 69
4822 358 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 70
4823 358 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 71
4824 358 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 72
4825 358 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 73
4826 358 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 74
4827 358 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 75
4828 358 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 76
4829 358 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 77
4830 358 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 78
4831 358 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 79
4832 358 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 80
4833 358 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 81
4834 358 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 82
4835 359 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 83
4836 359 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 84
4837 359 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 85
4838 359 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 86
4839 359 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 87
4840 359 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 88
4841 359 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 89
4842 359 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 90
4843 359 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 91
4844 359 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 92
4845 359 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 93
4846 359 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 94
4847 359 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 95
4848 360 2 Br 1 4 0 0 1 F s 5.317 2 -1 0 96
4849 360 2 Br 2 4 0 0 2 F s 3.476 2 -1 0 97
4850 360 2 Br 3 4 1 -1 1 F py 6.996 2 -1 0 98
4851 360 2 Br 4 4 1 0 1 F pz 6.996 2 -1 0 99
4852 360 2 Br 5 4 1 1 1 F px 6.996 2 -1 0 100
4853 360 2 Br 6 4 1 -1 2 F py 4.032 2 -1 0 101
4854 360 2 Br 7 4 1 0 2 F pz 4.032 2 -1 0 102
4855 360 2 Br 8 4 1 1 2 F px 4.032 2 -1 0 103
4856 360 2 Br 9 4 2 -2 1 T Pdxy 6.996 2 -1 0 104
4857 360 2 Br 10 4 2 -1 1 T Pdyz 6.996 2 -1 0 105
4858 360 2 Br 11 4 2 0 1 T Pdz2 6.996 2 -1 0 106
4859 360 2 Br 12 4 2 1 1 T Pdxz 6.996 2 -1 0 107
4860 360 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 2 -1 0 108
4861 361 1 Cr 1 4 0 0 1 F s 9.697 3 -1 0 1
4862 361 1 Cr 2 4 0 0 2 F s 8.001 3 -1 0 2
4863 361 1 Cr 3 4 1 -1 1 F py 14.099 3 -1 0 3
4864 361 1 Cr 4 4 1 0 1 F pz 14.099 3 -1 0 4
4865 361 1 Cr 5 4 1 1 1 F px 14.099 3 -1 0 5
4866 361 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -1 0 6
4867 361 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -1 0 7
4868 361 1 Cr 8 3 2 0 1 F dz2 7.210 3 -1 0 8
4869 361 1 Cr 9 3 2 1 1 F dxz 7.210 3 -1 0 9
4870 361 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -1 0 10
4871 361 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -1 0 11
4872 361 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -1 0 12
4873 361 1 Cr 13 3 2 0 2 F dz2 3.913 3 -1 0 13
4874 361 1 Cr 14 3 2 1 2 F dxz 3.913 3 -1 0 14
4875 361 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -1 0 15
4876 362 1 Cr 1 4 0 0 1 F s 9.697 3 -1 0 16
4877 362 1 Cr 2 4 0 0 2 F s 8.001 3 -1 0 17
4878 362 1 Cr 3 4 1 -1 1 F py 14.099 3 -1 0 18
4879 362 1 Cr 4 4 1 0 1 F pz 14.099 3 -1 0 19
4880 362 1 Cr 5 4 1 1 1 F px 14.099 3 -1 0 20
4881 362 1 Cr 6 3 2 -2 1 F dxy 7.210 3 -1 0 21
4882 362 1 Cr 7 3 2 -1 1 F dyz 7.210 3 -1 0 22
4883 362 1 Cr 8 3 2 0 1 F dz2 7.210 3 -1 0 23
4884 362 1 Cr 9 3 2 1 1 F dxz 7.210 3 -1 0 24
4885 362 1 Cr 10 3 2 2 1 F dx2-y2 7.210 3 -1 0 25
4886 362 1 Cr 11 3 2 -2 2 F dxy 3.913 3 -1 0 26
4887 362 1 Cr 12 3 2 -1 2 F dyz 3.913 3 -1 0 27
4888 362 1 Cr 13 3 2 0 2 F dz2 3.913 3 -1 0 28
4889 362 1 Cr 14 3 2 1 2 F dxz 3.913 3 -1 0 29
4890 362 1 Cr 15 3 2 2 2 F dx2-y2 3.913 3 -1 0 30
4891 363 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 31
4892 363 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 32
4893 363 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 33
4894 363 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 34
4895 363 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 35
4896 363 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 36
4897 363 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 37
4898 363 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 38
4899 363 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 39
4900 363 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 40
4901 363 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 41
4902 363 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 42
4903 363 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 43
4904 364 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 44
4905 364 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 45
4906 364 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 46
4907 364 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 47
4908 364 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 48
4909 364 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 49
4910 364 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 50
4911 364 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 51
4912 364 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 52
4913 364 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 53
4914 364 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 54
4915 364 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 55
4916 364 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 56
4917 365 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 57
4918 365 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 58
4919 365 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 59
4920 365 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 60
4921 365 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 61
4922 365 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 62
4923 365 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 63
4924 365 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 64
4925 365 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 65
4926 365 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 66
4927 365 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 67
4928 365 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 68
4929 365 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 69
4930 366 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 70
4931 366 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 71
4932 366 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 72
4933 366 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 73
4934 366 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 74
4935 366 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 75
4936 366 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 76
4937 366 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 77
4938 366 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 78
4939 366 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 79
4940 366 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 80
4941 366 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 81
4942 366 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 82
4943 367 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 83
4944 367 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 84
4945 367 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 85
4946 367 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 86
4947 367 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 87
4948 367 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 88
4949 367 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 89
4950 367 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 90
4951 367 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 91
4952 367 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 92
4953 367 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 93
4954 367 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 94
4955 367 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 95
4956 368 2 Br 1 4 0 0 1 F s 5.317 3 -1 0 96
4957 368 2 Br 2 4 0 0 2 F s 3.476 3 -1 0 97
4958 368 2 Br 3 4 1 -1 1 F py 6.996 3 -1 0 98
4959 368 2 Br 4 4 1 0 1 F pz 6.996 3 -1 0 99
4960 368 2 Br 5 4 1 1 1 F px 6.996 3 -1 0 100
4961 368 2 Br 6 4 1 -1 2 F py 4.032 3 -1 0 101
4962 368 2 Br 7 4 1 0 2 F pz 4.032 3 -1 0 102
4963 368 2 Br 8 4 1 1 2 F px 4.032 3 -1 0 103
4964 368 2 Br 9 4 2 -2 1 T Pdxy 6.996 3 -1 0 104
4965 368 2 Br 10 4 2 -1 1 T Pdyz 6.996 3 -1 0 105
4966 368 2 Br 11 4 2 0 1 T Pdz2 6.996 3 -1 0 106
4967 368 2 Br 12 4 2 1 1 T Pdxz 6.996 3 -1 0 107
4968 368 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 3 -1 0 108
4969 369 1 Cr 1 4 0 0 1 F s 9.697 -3 -1 0 1
4970 369 1 Cr 2 4 0 0 2 F s 8.001 -3 -1 0 2
4971 369 1 Cr 3 4 1 -1 1 F py 14.099 -3 -1 0 3
4972 369 1 Cr 4 4 1 0 1 F pz 14.099 -3 -1 0 4
4973 369 1 Cr 5 4 1 1 1 F px 14.099 -3 -1 0 5
4974 369 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -1 0 6
4975 369 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -1 0 7
4976 369 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -1 0 8
4977 369 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -1 0 9
4978 369 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -1 0 10
4979 369 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -1 0 11
4980 369 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -1 0 12
4981 369 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -1 0 13
4982 369 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -1 0 14
4983 369 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -1 0 15
4984 370 1 Cr 1 4 0 0 1 F s 9.697 -3 -1 0 16
4985 370 1 Cr 2 4 0 0 2 F s 8.001 -3 -1 0 17
4986 370 1 Cr 3 4 1 -1 1 F py 14.099 -3 -1 0 18
4987 370 1 Cr 4 4 1 0 1 F pz 14.099 -3 -1 0 19
4988 370 1 Cr 5 4 1 1 1 F px 14.099 -3 -1 0 20
4989 370 1 Cr 6 3 2 -2 1 F dxy 7.210 -3 -1 0 21
4990 370 1 Cr 7 3 2 -1 1 F dyz 7.210 -3 -1 0 22
4991 370 1 Cr 8 3 2 0 1 F dz2 7.210 -3 -1 0 23
4992 370 1 Cr 9 3 2 1 1 F dxz 7.210 -3 -1 0 24
4993 370 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -3 -1 0 25
4994 370 1 Cr 11 3 2 -2 2 F dxy 3.913 -3 -1 0 26
4995 370 1 Cr 12 3 2 -1 2 F dyz 3.913 -3 -1 0 27
4996 370 1 Cr 13 3 2 0 2 F dz2 3.913 -3 -1 0 28
4997 370 1 Cr 14 3 2 1 2 F dxz 3.913 -3 -1 0 29
4998 370 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -3 -1 0 30
4999 371 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 31
5000 371 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 32
5001 371 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 33
5002 371 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 34
5003 371 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 35
5004 371 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 36
5005 371 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 37
5006 371 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 38
5007 371 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 39
5008 371 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 40
5009 371 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 41
5010 371 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 42
5011 371 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 43
5012 372 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 44
5013 372 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 45
5014 372 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 46
5015 372 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 47
5016 372 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 48
5017 372 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 49
5018 372 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 50
5019 372 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 51
5020 372 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 52
5021 372 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 53
5022 372 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 54
5023 372 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 55
5024 372 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 56
5025 373 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 57
5026 373 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 58
5027 373 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 59
5028 373 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 60
5029 373 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 61
5030 373 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 62
5031 373 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 63
5032 373 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 64
5033 373 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 65
5034 373 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 66
5035 373 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 67
5036 373 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 68
5037 373 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 69
5038 374 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 70
5039 374 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 71
5040 374 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 72
5041 374 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 73
5042 374 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 74
5043 374 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 75
5044 374 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 76
5045 374 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 77
5046 374 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 78
5047 374 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 79
5048 374 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 80
5049 374 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 81
5050 374 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 82
5051 375 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 83
5052 375 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 84
5053 375 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 85
5054 375 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 86
5055 375 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 87
5056 375 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 88
5057 375 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 89
5058 375 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 90
5059 375 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 91
5060 375 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 92
5061 375 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 93
5062 375 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 94
5063 375 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 95
5064 376 2 Br 1 4 0 0 1 F s 5.317 -3 -1 0 96
5065 376 2 Br 2 4 0 0 2 F s 3.476 -3 -1 0 97
5066 376 2 Br 3 4 1 -1 1 F py 6.996 -3 -1 0 98
5067 376 2 Br 4 4 1 0 1 F pz 6.996 -3 -1 0 99
5068 376 2 Br 5 4 1 1 1 F px 6.996 -3 -1 0 100
5069 376 2 Br 6 4 1 -1 2 F py 4.032 -3 -1 0 101
5070 376 2 Br 7 4 1 0 2 F pz 4.032 -3 -1 0 102
5071 376 2 Br 8 4 1 1 2 F px 4.032 -3 -1 0 103
5072 376 2 Br 9 4 2 -2 1 T Pdxy 6.996 -3 -1 0 104
5073 376 2 Br 10 4 2 -1 1 T Pdyz 6.996 -3 -1 0 105
5074 376 2 Br 11 4 2 0 1 T Pdz2 6.996 -3 -1 0 106
5075 376 2 Br 12 4 2 1 1 T Pdxz 6.996 -3 -1 0 107
5076 376 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -3 -1 0 108
5077 377 1 Cr 1 4 0 0 1 F s 9.697 -2 -1 0 1
5078 377 1 Cr 2 4 0 0 2 F s 8.001 -2 -1 0 2
5079 377 1 Cr 3 4 1 -1 1 F py 14.099 -2 -1 0 3
5080 377 1 Cr 4 4 1 0 1 F pz 14.099 -2 -1 0 4
5081 377 1 Cr 5 4 1 1 1 F px 14.099 -2 -1 0 5
5082 377 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -1 0 6
5083 377 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -1 0 7
5084 377 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -1 0 8
5085 377 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -1 0 9
5086 377 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -1 0 10
5087 377 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -1 0 11
5088 377 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -1 0 12
5089 377 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -1 0 13
5090 377 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -1 0 14
5091 377 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -1 0 15
5092 378 1 Cr 1 4 0 0 1 F s 9.697 -2 -1 0 16
5093 378 1 Cr 2 4 0 0 2 F s 8.001 -2 -1 0 17
5094 378 1 Cr 3 4 1 -1 1 F py 14.099 -2 -1 0 18
5095 378 1 Cr 4 4 1 0 1 F pz 14.099 -2 -1 0 19
5096 378 1 Cr 5 4 1 1 1 F px 14.099 -2 -1 0 20
5097 378 1 Cr 6 3 2 -2 1 F dxy 7.210 -2 -1 0 21
5098 378 1 Cr 7 3 2 -1 1 F dyz 7.210 -2 -1 0 22
5099 378 1 Cr 8 3 2 0 1 F dz2 7.210 -2 -1 0 23
5100 378 1 Cr 9 3 2 1 1 F dxz 7.210 -2 -1 0 24
5101 378 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -2 -1 0 25
5102 378 1 Cr 11 3 2 -2 2 F dxy 3.913 -2 -1 0 26
5103 378 1 Cr 12 3 2 -1 2 F dyz 3.913 -2 -1 0 27
5104 378 1 Cr 13 3 2 0 2 F dz2 3.913 -2 -1 0 28
5105 378 1 Cr 14 3 2 1 2 F dxz 3.913 -2 -1 0 29
5106 378 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -2 -1 0 30
5107 379 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 31
5108 379 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 32
5109 379 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 33
5110 379 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 34
5111 379 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 35
5112 379 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 36
5113 379 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 37
5114 379 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 38
5115 379 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 39
5116 379 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 40
5117 379 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 41
5118 379 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 42
5119 379 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 43
5120 380 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 44
5121 380 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 45
5122 380 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 46
5123 380 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 47
5124 380 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 48
5125 380 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 49
5126 380 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 50
5127 380 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 51
5128 380 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 52
5129 380 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 53
5130 380 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 54
5131 380 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 55
5132 380 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 56
5133 381 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 57
5134 381 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 58
5135 381 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 59
5136 381 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 60
5137 381 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 61
5138 381 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 62
5139 381 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 63
5140 381 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 64
5141 381 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 65
5142 381 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 66
5143 381 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 67
5144 381 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 68
5145 381 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 69
5146 382 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 70
5147 382 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 71
5148 382 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 72
5149 382 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 73
5150 382 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 74
5151 382 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 75
5152 382 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 76
5153 382 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 77
5154 382 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 78
5155 382 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 79
5156 382 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 80
5157 382 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 81
5158 382 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 82
5159 383 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 83
5160 383 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 84
5161 383 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 85
5162 383 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 86
5163 383 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 87
5164 383 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 88
5165 383 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 89
5166 383 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 90
5167 383 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 91
5168 383 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 92
5169 383 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 93
5170 383 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 94
5171 383 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 95
5172 384 2 Br 1 4 0 0 1 F s 5.317 -2 -1 0 96
5173 384 2 Br 2 4 0 0 2 F s 3.476 -2 -1 0 97
5174 384 2 Br 3 4 1 -1 1 F py 6.996 -2 -1 0 98
5175 384 2 Br 4 4 1 0 1 F pz 6.996 -2 -1 0 99
5176 384 2 Br 5 4 1 1 1 F px 6.996 -2 -1 0 100
5177 384 2 Br 6 4 1 -1 2 F py 4.032 -2 -1 0 101
5178 384 2 Br 7 4 1 0 2 F pz 4.032 -2 -1 0 102
5179 384 2 Br 8 4 1 1 2 F px 4.032 -2 -1 0 103
5180 384 2 Br 9 4 2 -2 1 T Pdxy 6.996 -2 -1 0 104
5181 384 2 Br 10 4 2 -1 1 T Pdyz 6.996 -2 -1 0 105
5182 384 2 Br 11 4 2 0 1 T Pdz2 6.996 -2 -1 0 106
5183 384 2 Br 12 4 2 1 1 T Pdxz 6.996 -2 -1 0 107
5184 384 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -2 -1 0 108
5185 385 1 Cr 1 4 0 0 1 F s 9.697 -1 -1 0 1
5186 385 1 Cr 2 4 0 0 2 F s 8.001 -1 -1 0 2
5187 385 1 Cr 3 4 1 -1 1 F py 14.099 -1 -1 0 3
5188 385 1 Cr 4 4 1 0 1 F pz 14.099 -1 -1 0 4
5189 385 1 Cr 5 4 1 1 1 F px 14.099 -1 -1 0 5
5190 385 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -1 0 6
5191 385 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -1 0 7
5192 385 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -1 0 8
5193 385 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -1 0 9
5194 385 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -1 0 10
5195 385 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -1 0 11
5196 385 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -1 0 12
5197 385 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -1 0 13
5198 385 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -1 0 14
5199 385 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -1 0 15
5200 386 1 Cr 1 4 0 0 1 F s 9.697 -1 -1 0 16
5201 386 1 Cr 2 4 0 0 2 F s 8.001 -1 -1 0 17
5202 386 1 Cr 3 4 1 -1 1 F py 14.099 -1 -1 0 18
5203 386 1 Cr 4 4 1 0 1 F pz 14.099 -1 -1 0 19
5204 386 1 Cr 5 4 1 1 1 F px 14.099 -1 -1 0 20
5205 386 1 Cr 6 3 2 -2 1 F dxy 7.210 -1 -1 0 21
5206 386 1 Cr 7 3 2 -1 1 F dyz 7.210 -1 -1 0 22
5207 386 1 Cr 8 3 2 0 1 F dz2 7.210 -1 -1 0 23
5208 386 1 Cr 9 3 2 1 1 F dxz 7.210 -1 -1 0 24
5209 386 1 Cr 10 3 2 2 1 F dx2-y2 7.210 -1 -1 0 25
5210 386 1 Cr 11 3 2 -2 2 F dxy 3.913 -1 -1 0 26
5211 386 1 Cr 12 3 2 -1 2 F dyz 3.913 -1 -1 0 27
5212 386 1 Cr 13 3 2 0 2 F dz2 3.913 -1 -1 0 28
5213 386 1 Cr 14 3 2 1 2 F dxz 3.913 -1 -1 0 29
5214 386 1 Cr 15 3 2 2 2 F dx2-y2 3.913 -1 -1 0 30
5215 387 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 31
5216 387 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 32
5217 387 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 33
5218 387 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 34
5219 387 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 35
5220 387 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 36
5221 387 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 37
5222 387 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 38
5223 387 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 39
5224 387 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 40
5225 387 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 41
5226 387 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 42
5227 387 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 43
5228 388 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 44
5229 388 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 45
5230 388 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 46
5231 388 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 47
5232 388 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 48
5233 388 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 49
5234 388 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 50
5235 388 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 51
5236 388 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 52
5237 388 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 53
5238 388 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 54
5239 388 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 55
5240 388 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 56
5241 389 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 57
5242 389 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 58
5243 389 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 59
5244 389 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 60
5245 389 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 61
5246 389 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 62
5247 389 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 63
5248 389 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 64
5249 389 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 65
5250 389 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 66
5251 389 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 67
5252 389 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 68
5253 389 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 69
5254 390 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 70
5255 390 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 71
5256 390 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 72
5257 390 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 73
5258 390 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 74
5259 390 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 75
5260 390 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 76
5261 390 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 77
5262 390 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 78
5263 390 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 79
5264 390 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 80
5265 390 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 81
5266 390 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 82
5267 391 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 83
5268 391 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 84
5269 391 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 85
5270 391 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 86
5271 391 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 87
5272 391 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 88
5273 391 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 89
5274 391 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 90
5275 391 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 91
5276 391 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 92
5277 391 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 93
5278 391 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 94
5279 391 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 95
5280 392 2 Br 1 4 0 0 1 F s 5.317 -1 -1 0 96
5281 392 2 Br 2 4 0 0 2 F s 3.476 -1 -1 0 97
5282 392 2 Br 3 4 1 -1 1 F py 6.996 -1 -1 0 98
5283 392 2 Br 4 4 1 0 1 F pz 6.996 -1 -1 0 99
5284 392 2 Br 5 4 1 1 1 F px 6.996 -1 -1 0 100
5285 392 2 Br 6 4 1 -1 2 F py 4.032 -1 -1 0 101
5286 392 2 Br 7 4 1 0 2 F pz 4.032 -1 -1 0 102
5287 392 2 Br 8 4 1 1 2 F px 4.032 -1 -1 0 103
5288 392 2 Br 9 4 2 -2 1 T Pdxy 6.996 -1 -1 0 104
5289 392 2 Br 10 4 2 -1 1 T Pdyz 6.996 -1 -1 0 105
5290 392 2 Br 11 4 2 0 1 T Pdz2 6.996 -1 -1 0 106
5291 392 2 Br 12 4 2 1 1 T Pdxz 6.996 -1 -1 0 107
5292 392 2 Br 13 4 2 2 1 T Pdx2-y2 6.996 -1 -1 0 108
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
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