0 mol 1 unq 0 iso 0 dist 6.35771 9.78282 7.73435 11.9399 7.27254 11.6921 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.35771 4.43123 5.71995 11.9399 7.27254 10.2632 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.32155 7.56926 7.31982 10.4149 7.15901 4.55347 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.61675 9.46892 4.75776 5.8992 6.2676 5.04054 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 9.64645 8.95538 4.75776 6.05689 6.2676 5.04054 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 6.59067 6.70602 6.91393 9.87628 5.07125 8.12964 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 6.59067 9.48435 8.40038 9.87628 5.07125 11.6453 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.26179 17.8038 8.58543 15.7193 7.69861 5.24993 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.89116 12.9632 8.03035 15.7791 9.6121 6.71103 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.89116 12.9632 8.03035 13.4766 9.57341 6.29394 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 9.89116 4.31572 7.6968 15.7791 9.6121 12.4868 numMergedOcc 0
11 mol 119 unq 3 iso 0 dist 9.89116 4.31572 7.6968 13.4766 9.57341 9.64502 numMergedOcc 0
12 mol 140 unq 0 iso 0 dist 9.62457 12.2348 6.98813 6.52033 7.19291 7.10913 numMergedOcc 0
13 mol 140 unq 1 iso 0 dist 9.62457 12.2348 6.98813 11.9098 6.66504 6.30391 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 6.78772 11.7112 8.26172 12.017 6.77921 10.2834 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.52352 4.88215 5.73236 10.8782 7.16698 6.55089 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 7.52352 4.88215 5.73236 9.42107 8.68663 6.16103 numMergedOcc 0
17 mol 143 unq 2 iso 0 dist 7.23619 10.8542 5.73236 12.018 8.68663 6.16103 numMergedOcc 0
18 mol 143 unq 3 iso 0 dist 7.23619 10.8542 5.73236 6.75596 7.16698 6.55089 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 7.91764 8.57004 8.5865 7.0718 9.79338 14.8261 numMergedOcc 0
20 mol 176 unq 1 iso 0 dist 7.72366 4.80665 8.5865 11.9775 9.79338 14.8261 numMergedOcc 0
21 mol 176 unq 2 iso 0 dist 8.84411 10.0219 8.5865 11.0966 9.79338 14.8261 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.52129 10.4401 9.89583 6.10342 6.53286 13.0611 numMergedOcc 0
23 mol 284 unq 0 iso 0 dist 5.71854 10.5039 7.97588 10.3623 9.07503 5.54893 numMergedOcc 0
24 mol 284 unq 1 iso 0 dist 5.71854 10.5039 7.97588 7.89015 7.63256 3.89435 numMergedOcc 0
25 mol 284 unq 2 iso 0 dist 7.66625 9.06151 7.97588 5.26543 9.07503 5.54893 numMergedOcc 0
26 mol 284 unq 3 iso 0 dist 7.66625 9.06151 7.97588 6.6556 7.63256 3.89435 numMergedOcc 0
