0 mol 8 unq 0 iso 0 dist 9.73496 8.82216 8.80278 5.53899 9.36839 4.35292 15.7716 9.60336 8.76702 11.6352 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.73496 8.82216 8.80278 5.53899 9.36839 4.35292 15.0004 13.4423 6.27477 9.97264 numMergedOcc 0
2 mol 86 unq 0 iso 0 dist 8.45341 11.4158 7.18799 5.16705 9.62655 8.79483 11.0739 5.19926 7.26032 11.2976 numMergedOcc 0
3 mol 86 unq 1 iso 0 dist 8.45341 9.68657 8.4254 5.16705 9.62655 8.47281 11.0739 5.19926 5.49793 11.2976 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.8915 9.17593 8.70106 8.5691 7.81042 11.4822 13.026 10.2138 5.94478 15.1643 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 6.15949 8.20626 5.66196 5.67441 5.31281 5.6579 6.71345 5.24877 5.87387 8.42445 numMergedOcc 0
6 mol 114 unq 1 iso 0 dist 6.15949 8.20626 5.66196 5.67441 5.31281 5.6579 11.7295 8.47567 6.06543 11.2415 numMergedOcc 0
7 mol 114 unq 2 iso 0 dist 6.15949 8.20626 5.66196 10.0602 8.9922 4.77912 6.71345 5.24877 5.87387 10.2889 numMergedOcc 0
8 mol 114 unq 3 iso 0 dist 6.15949 8.20626 5.66196 10.0602 8.9922 4.77912 11.7295 8.47567 6.06543 10.4242 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 9.40595 12.7248 7.80819 14.8513 7.25133 4.30864 13.6842 4.57807 9.2806 7.11388 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 6.4413 8.90222 5.86949 13.2694 9.71692 6.33907 7.95671 5.34721 8.62898 14.0476 numMergedOcc 0
11 mol 148 unq 1 iso 0 dist 6.4413 11.3382 6.72591 13.2694 9.71692 7.50382 17.9174 12.9245 9.7168 16.4612 numMergedOcc 0
12 mol 148 unq 2 iso 0 dist 6.4413 11.3382 6.72591 13.2694 9.71692 7.50382 16.8526 10.5987 7.38138 10.69 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 6.62609 8.93873 5.84971 13.3379 9.73708 6.43607 8.12659 5.38822 8.6102 14.1199 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 6.62609 11.5334 6.80192 13.3379 9.73708 7.48524 18.0229 12.8684 9.61132 16.3796 numMergedOcc 0
15 mol 150 unq 2 iso 0 dist 6.62609 11.5334 6.80192 13.3379 9.73708 7.48524 16.9258 10.4881 7.34423 10.6513 numMergedOcc 0
16 mol 189 unq 0 iso 0 dist 6.77351 10.3814 8.81184 6.32602 8.23197 12.7403 18.0396 13.1061 9.58744 19.7861 numMergedOcc 0
17 mol 189 unq 1 iso 0 dist 8.4676 16.383 8.81184 9.84174 8.23197 12.7403 20.9954 13.1061 9.58744 19.7861 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 8.32703 12.1436 9.09371 5.55239 5.2851 9.22288 11.3699 5.71921 9.93154 10.2913 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 8.32703 12.1436 9.09371 5.55239 5.2851 9.22288 16.5808 9.08864 9.18218 13.1699 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 8.32703 12.1436 9.09371 5.55239 5.2851 9.22288 15.5504 8.98613 6.18486 11.3667 numMergedOcc 0
21 mol 227 unq 3 iso 0 dist 8.25412 14.3715 9.09371 5.34424 5.2851 9.22288 13.6898 5.71921 9.93154 10.2913 numMergedOcc 0
22 mol 227 unq 4 iso 0 dist 8.25412 14.3715 9.09371 5.34424 5.2851 9.22288 16.7007 9.08864 9.18218 13.1699 numMergedOcc 0
23 mol 227 unq 5 iso 0 dist 8.25412 14.3715 9.09371 5.34424 5.2851 9.22288 15.3272 8.98613 6.18486 11.3667 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 18.2946 11.3048 9.22576 12.0651 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 18.2946 11.3048 9.22576 12.0651 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.80626 9.56395 4.66252 10.6818 4.49185 5.44878 18.2946 11.3048 9.22576 12.0651 numMergedOcc 0
