0 mol 36 unq 0 iso 0 dist 7.34287 10.6452 8.05598 4.09734 5.58536 9.13772 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.82468 14.1088 8.61163 12.3013 7.77212 5.8646 numMergedOcc 0
2 mol 53 unq 1 iso 0 dist 9.5429 6.5074 7.80805 4.45141 9.72637 5.20563 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.91602 7.08612 6.05043 10.0655 9.64287 4.23405 numMergedOcc 0
4 mol 136 unq 0 iso 0 dist 9.44126 10.7369 6.53519 8.28142 7.75661 4.22085 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 6.3518 4.68256 4.96326 4.53563 7.02812 5.02061 numMergedOcc 0
6 mol 182 unq 0 iso 0 dist 4.45763 8.27436 7.8621 6.34768 7.01577 6.1548 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 8.64985 14.2151 9.05666 4.95833 8.42665 12.1342 numMergedOcc 0
8 mol 192 unq 1 iso 0 dist 9.54594 10.9985 9.05666 5.19436 8.42665 12.1342 numMergedOcc 0
9 mol 198 unq 0 iso 0 dist 8.80787 14.9605 9.4363 11.0465 6.13687 4.27652 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 8.04498 4.65392 7.92766 4.79731 7.8518 6.49075 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 8.04498 11.0965 6.32652 4.79731 7.8518 8.62057 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 8.90975 8.58242 4.71403 3.57799 6.19516 5.99437 numMergedOcc 0
13 mol 276 unq 0 iso 0 dist 5.39708 5.58984 7.11272 13.1666 9.97709 9.89329 numMergedOcc 0
14 mol 276 unq 1 iso 0 dist 5.39708 5.82952 6.24808 13.1666 9.97709 12.1499 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 9.03915 11.7457 9.58494 3.47973 6.01365 11.0149 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.3522 6.2858 7.28096 4.11081 6.17759 7.83168 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 7.3522 6.2858 7.28096 8.44024 8.20391 10.0322 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 9.86256 10.7231 9.22576 14.9936 8.08382 6.68639 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.3522 6.2858 7.28096 4.11081 6.17759 7.83168 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.3522 6.2858 7.28096 8.44024 8.20391 10.0322 numMergedOcc 0
21 mol 288 unq 2 iso 0 dist 9.86256 10.7231 9.22576 14.9936 8.08382 6.68639 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.3522 6.2858 7.28096 4.11081 6.17759 7.83168 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 7.3522 6.2858 7.28096 8.44024 8.20391 10.0322 numMergedOcc 0
24 mol 289 unq 2 iso 0 dist 9.86256 10.7231 9.22576 14.9936 8.08382 6.68639 numMergedOcc 0
