0 mol 1 unq 0 iso 0 dist 7.94669 7.81034 4.95929 7.90928 12.4732 9.57393 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.94669 9.19497 5.11065 7.90928 12.4732 12.4382 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 8.34804 8.39857 14.8076 5.70192 13.1761 4.50024 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.25561 9.33989 6.6711 8.6411 8.78942 5.70125 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.97499 8.57953 6.6711 8.94956 8.78942 5.70125 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 5.74637 8.87089 6.09578 5.82918 8.71166 11.5264 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 7.40577 5.82456 9.50189 6.96057 4.8628 8.67095 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 7.40577 5.82456 9.50189 9.78437 12.5418 11.5584 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.61448 5.84909 8.13581 8.9344 6.95294 5.28979 numMergedOcc 0
9 mol 146 unq 0 iso 0 dist 9.48667 6.14952 4.92417 9.77771 7.14836 5.03111 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 5.16143 9.25488 4.41993 8.02593 7.00069 8.59213 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 5.16143 8.02356 5.55092 8.02593 7.00069 6.6805 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 8.66172 9.24754 13.6047 8.70104 13.2873 13.3436 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 6.89529 9.24754 8.08989 8.70104 10.4425 13.3436 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 7.7013 8.57666 4.40729 9.00025 14.9849 16.553 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 8.2968 8.85182 4.94279 8.60027 4.72576 6.81717 numMergedOcc 0
16 mol 185 unq 1 iso 0 dist 8.2968 5.7065 7.94486 8.60027 4.72576 7.04364 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 5.33103 5.70065 9.12311 6.87234 10.514 6.86988 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 5.33103 5.70065 9.12311 8.72017 8.55471 10.1915 numMergedOcc 0
19 mol 210 unq 2 iso 0 dist 9.01301 5.70065 7.75472 6.87234 12.685 6.86988 numMergedOcc 0
20 mol 210 unq 3 iso 0 dist 9.01301 5.70065 7.75472 8.72017 11.7269 10.1915 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 8.20542 9.51001 13.8826 6.98151 11.4732 4.71339 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 8.93135 7.12027 4.91848 9.94175 5.32456 5.2394 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 5.9919 7.15878 6.15362 5.18952 7.8097 4.47004 numMergedOcc 0
24 mol 239 unq 1 iso 0 dist 5.9919 7.15878 6.15362 5.648 6.62046 7.14566 numMergedOcc 0
