0 mol 4 unq 0 iso 0 dist 4.88114 6.12485 9.84838 9.04027 7.03689 9.77707 6.21697 10.9924 6.86951 14.3341 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 9.75299 8.49962 4.78627 5.76037 7.24183 5.41357 9.30042 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 7.8986 9.75299 8.49962 8.52643 7.05519 4.78627 5.76037 7.24183 9.30042 5.41357 numMergedOcc 0
3 mol 64 unq 2 iso 0 dist 7.24183 5.41357 7.05519 9.30042 8.49962 4.78627 5.76037 7.8986 8.52643 9.75299 numMergedOcc 0
4 mol 64 unq 3 iso 0 dist 7.24183 9.30042 8.49962 5.41357 7.05519 4.78627 5.76037 7.8986 9.75299 8.52643 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.92936 9.47045 9.95663 7.48556 4.97519 8.96403 11.7643 12.762 8.07498 14.7134 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.92936 9.47045 9.95663 8.68218 6.87319 4.84196 11.7643 12.762 8.07498 7.46419 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 5.92936 8.68218 6.87319 7.48556 4.97519 7.99821 11.7643 12.762 7.46419 14.7134 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 5.92936 8.68218 6.87319 9.47045 9.95663 4.84196 11.7643 12.762 7.46419 8.07498 numMergedOcc 0
9 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 5.63748 7.43534 10.445 6.69898 10.4317 7.57471 11.1249 numMergedOcc 0
10 mol 87 unq 1 iso 0 dist 9.10245 5.63748 7.43534 9.90256 5.83874 10.445 5.38943 12.3515 5.62336 14.3873 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 7.81042 8.078 8.96379 6.56481 5.73608 11.6637 6.73664 13.0426 7.66418 13.1619 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 8.05043 7.60956 4.8476 9.9171 8.53976 5.17212 8.73614 12.7279 9.13339 11.3016 numMergedOcc 0
13 mol 189 unq 0 iso 0 dist 7.04604 7.54658 4.92169 6.77641 9.94485 6.4062 8.91303 5.11059 9.95686 14.0544 numMergedOcc 0
14 mol 189 unq 1 iso 0 dist 5.11059 9.95686 4.92169 9.47321 8.03657 10.4321 8.91303 7.04604 7.54658 14.5375 numMergedOcc 0
15 mol 189 unq 2 iso 0 dist 5.11059 9.47321 8.03657 9.95686 4.92169 10.4321 8.74557 10.0857 6.38294 13.9052 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.86207 8.57174 14.3078 9.89039 9.09963 15.5559 12.1405 14.4096 6.80214 18.0464 numMergedOcc 0
17 mol 245 unq 0 iso 0 dist 7.26913 7.95061 11.8346 9.96585 6.25662 14.3262 15.2703 20.9689 9.5096 22.6305 numMergedOcc 0
18 mol 245 unq 1 iso 0 dist 7.26913 7.95061 11.8346 7.27022 4.38291 9.67137 15.2703 20.9689 9.5096 18.6442 numMergedOcc 0
19 mol 245 unq 2 iso 0 dist 6.41862 7.95061 3.53109 9.96585 14.6391 14.3262 15.2703 10.8718 9.5096 22.6305 numMergedOcc 0
20 mol 245 unq 3 iso 0 dist 6.41862 7.95061 3.53109 7.27022 10.1523 9.67137 15.2703 10.8718 9.5096 18.6442 numMergedOcc 0
21 mol 245 unq 4 iso 0 dist 8.69377 7.95061 9.71014 9.96585 17.4904 14.3262 15.2703 15.1895 9.5096 22.6305 numMergedOcc 0
22 mol 245 unq 5 iso 0 dist 8.69377 7.95061 9.71014 7.27022 13.6404 9.67137 15.2703 15.1895 9.5096 18.6442 numMergedOcc 0
23 mol 245 unq 6 iso 0 dist 8.26223 9.5096 4.20594 8.0848 4.03241 7.00614 15.2703 12.0339 7.95061 13.7347 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 6.08181 7.25618 11.0025 8.10903 10.8957 5.31174 7.64421 13.3732 8.70193 11.866 numMergedOcc 0
25 mol 258 unq 1 iso 0 dist 7.70189 7.25618 9.46467 8.10903 5.27718 5.31174 7.64421 12.9422 8.70193 11.866 numMergedOcc 0
26 mol 261 unq 0 iso 0 dist 9.70222 4.85199 10.6318 9.72159 4.97878 10.4196 4.70691 14.3042 6.0437 13.9529 numMergedOcc 0
27 mol 261 unq 1 iso 0 dist 9.70222 4.85199 10.6318 9.72159 4.97878 10.4196 6.43452 9.71882 9.13604 6.89731 numMergedOcc 0
28 mol 261 unq 2 iso 0 dist 9.70222 9.72159 4.97878 4.85199 10.6318 10.4196 6.43452 9.71882 6.89731 9.13604 numMergedOcc 0
29 mol 261 unq 3 iso 0 dist 9.71882 9.13604 10.6318 6.89731 4.97878 10.4196 9.51335 14.3042 6.0437 13.9529 numMergedOcc 0
30 mol 261 unq 4 iso 0 dist 9.71882 9.13604 10.6318 6.89731 4.97878 10.4196 6.43452 9.70222 4.85199 9.72159 numMergedOcc 0
31 mol 261 unq 5 iso 0 dist 9.71882 9.13604 10.6318 9.85607 9.35886 10.8346 9.51335 14.3042 6.0437 15.4656 numMergedOcc 0
32 mol 261 unq 6 iso 0 dist 9.71882 9.13604 10.6318 9.85607 9.35886 10.8346 6.43452 9.70222 4.85199 12.3279 numMergedOcc 0
33 mol 261 unq 7 iso 0 dist 9.71882 6.89731 4.97878 9.13604 10.6318 10.4196 6.43452 9.70222 9.72159 4.85199 numMergedOcc 0
34 mol 261 unq 8 iso 0 dist 9.71882 6.89731 4.97878 9.85607 9.35886 5.65316 6.43452 9.70222 9.72159 12.3279 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 9.63694 6.57444 13.1376 7.9555 14.6225 5.77131 13.1611 21.9878 9.39714 10.1316 numMergedOcc 0
36 mol 266 unq 1 iso 0 dist 9.63694 7.9555 14.6225 6.57444 13.1376 5.77131 6.70676 11.475 8.8646 11.4453 numMergedOcc 0
37 mol 266 unq 2 iso 0 dist 6.58277 6.57444 5.91091 7.9555 3.93133 5.77131 13.1611 8.12204 9.39714 10.1316 numMergedOcc 0
38 mol 266 unq 3 iso 0 dist 6.58277 7.9555 3.93133 6.57444 5.91091 5.77131 6.70676 8.42706 8.8646 11.4453 numMergedOcc 0
39 mol 282 unq 0 iso 0 dist 8.61456 5.00258 9.80233 9.98886 4.68809 10.6828 4.79603 13.2778 6.04225 14.3467 numMergedOcc 0
40 mol 282 unq 1 iso 0 dist 8.61456 5.00258 9.80233 9.98886 4.68809 10.6828 5.92133 8.41041 8.22117 6.81887 numMergedOcc 0
41 mol 282 unq 2 iso 0 dist 8.61456 9.98886 4.68809 5.00258 9.80233 10.6828 5.92133 8.41041 6.81887 8.22117 numMergedOcc 0
42 mol 282 unq 3 iso 0 dist 8.41041 8.22117 9.80233 6.81887 4.68809 10.6828 9.24679 13.2778 6.04225 14.3467 numMergedOcc 0
43 mol 282 unq 4 iso 0 dist 8.41041 8.22117 9.80233 6.81887 4.68809 10.6828 5.92133 8.61456 5.00258 9.98886 numMergedOcc 0
44 mol 282 unq 5 iso 0 dist 8.41041 6.81887 4.68809 8.22117 9.80233 10.6828 5.92133 8.61456 9.98886 5.00258 numMergedOcc 0
