0 mol 53 unq 0 iso 0 dist 6.26613 12.858 8.79235 16.2667 10.7201 7.28228 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.96214 4.55988 8.25594 11.8011 15.6547 9.03564 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 9.67476 6.00324 6.44825 13.2694 11 8.3733 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 8.09587 9.4173 8.12959 9.79714 13.0619 8.13108 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 7.52544 4.05111 6.14248 11.415 5.82267 8.23026 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 8.08674 4.05111 6.97936 11.415 12.6179 8.23026 numMergedOcc 0
6 mol 76 unq 3 iso 0 dist 8.33694 4.05111 5.00466 11.415 7.88072 8.23026 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 9.83241 5.71616 9.31543 9.54663 4.80675 6.69691 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 9.83241 11.0564 8.85652 9.54663 4.80675 5.51197 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.70916 5.39761 9.7105 10.9887 9.71227 7.22643 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 7.67974 4.16926 8.8774 7.21035 4.85077 9.56028 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.78385 9.6256 5.27578 13.8252 7.82249 9.3498 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 7.78385 9.6256 5.27578 15.7122 9.09826 7.05695 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 7.17789 6.70611 5.27578 9.73745 7.82249 9.3498 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.17789 6.70611 5.27578 11.305 9.09826 7.05695 numMergedOcc 0
15 mol 186 unq 4 iso 0 dist 8.86673 5.60861 9.76574 7.69466 10.0248 8.73533 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 7.73969 7.15922 9.67162 6.67907 5.52669 8.23087 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 9.91996 5.48725 8.27649 5.16581 5.54149 6.34915 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 9.91996 5.48725 8.27649 5.13633 10.8918 7.81897 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 6.92271 14.6762 9.91103 18.2066 16.3552 9.57499 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 6.92271 14.6762 9.91103 12.4435 10.4297 5.46926 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 6.92271 14.6762 9.91103 6.86014 5.77904 8.9682 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 6.92271 11.68 7.0603 12.4435 10.4297 5.13913 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 6.92271 11.68 7.0603 6.86014 5.77904 6.92711 numMergedOcc 0
24 mol 277 unq 5 iso 0 dist 8.62666 11.3103 9.91103 12.8364 16.3552 9.57499 numMergedOcc 0
25 mol 277 unq 6 iso 0 dist 8.62666 11.3103 9.91103 11.2713 10.4297 5.46926 numMergedOcc 0
26 mol 277 unq 7 iso 0 dist 8.62666 11.3103 9.91103 5.97073 5.77904 8.9682 numMergedOcc 0
27 mol 277 unq 8 iso 0 dist 8.62666 10.5734 7.0603 11.2713 10.4297 5.13913 numMergedOcc 0
28 mol 277 unq 9 iso 0 dist 8.62666 10.5734 7.0603 5.97073 5.77904 6.92711 numMergedOcc 0
