0 mol 51 unq 0 iso 0 dist 9.26014 6.4918 7.76282 13.7098 9.40732 9.29602 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 9.10096 11.5552 6.77886 12.8186 8.76402 11.2854 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 9.10096 11.5552 6.77886 6.46922 5.6727 5.19333 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 9.43351 4.28796 8.16733 6.70915 7.55497 4.47969 numMergedOcc 0
4 mol 94 unq 1 iso 0 dist 9.43351 6.14092 9.97569 6.70915 7.55497 11.165 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.48788 6.69791 5.88354 11.5894 8.12456 5.68803 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.48788 6.7822 7.89665 11.5894 8.12456 8.28823 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.48788 9.86407 5.39354 11.5894 8.12456 5.8011 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.48788 10.9221 5.74854 11.5894 8.12456 5.68885 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 5.48788 9.71558 8.76566 11.5894 8.12456 11.4897 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 5.48788 11.3525 8.8368 11.5894 8.12456 14.0498 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 8.2866 5.64994 9.11712 9.79911 6.03843 10.5348 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 8.56251 4.51874 4.92088 8.29775 7.88301 6.39077 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 5.89229 4.33607 8.20691 9.63052 6.42817 9.03641 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 7.44979 10.4409 8.0144 6.4596 5.38027 5.37945 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 7.44979 11.4774 7.80841 6.4596 5.38027 7.39832 numMergedOcc 0
16 mol 204 unq 2 iso 0 dist 9.4236 6.10425 8.0144 5.58591 5.38027 5.37945 numMergedOcc 0
17 mol 204 unq 3 iso 0 dist 9.4236 7.34669 7.80841 5.58591 5.38027 7.39832 numMergedOcc 0
18 mol 252 unq 0 iso 0 dist 7.82138 7.66494 6.11473 9.80886 7.19006 12.0836 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 4.37724 9.41638 7.91611 10.0714 9.99503 6.14573 numMergedOcc 0
