0 mol 36 unq 0 iso 0 dist 7.34287 10.5589 6.02824 4.09734 5.58536 7.69482 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.69318 5.06459 5.92285 5.4275 6.42645 5.98227 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 7.69318 10.6475 8.38687 5.4275 6.42645 5.87787 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 9.91602 5.9335 9.05612 10.0655 9.64287 5.38692 numMergedOcc 0
4 mol 168 unq 0 iso 0 dist 7.38495 9.82889 4.68544 15.1851 8.1953 8.60565 numMergedOcc 0
5 mol 168 unq 1 iso 0 dist 7.38495 9.82889 4.68544 14.4685 8.16253 5.62227 numMergedOcc 0
6 mol 168 unq 2 iso 0 dist 6.75751 5.5458 4.68544 4.18108 8.1953 8.60565 numMergedOcc 0
7 mol 168 unq 3 iso 0 dist 6.75751 5.5458 4.68544 3.6038 8.16253 5.62227 numMergedOcc 0
8 mol 168 unq 4 iso 0 dist 8.35883 4.858 4.68544 8.29185 8.1953 8.60565 numMergedOcc 0
9 mol 168 unq 5 iso 0 dist 8.35883 4.858 4.68544 4.88037 8.16253 5.62227 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 6.22076 6.54932 9.34557 4.71092 8.25547 3.51753 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 6.22076 4.91613 8.83844 4.71092 8.25547 7.20382 numMergedOcc 0
12 mol 171 unq 2 iso 0 dist 8.30602 13.4051 9.34557 10.7165 8.25547 3.51753 numMergedOcc 0
13 mol 171 unq 3 iso 0 dist 8.30602 4.61696 8.83844 10.7165 8.25547 7.20382 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 8.80787 5.75465 8.80827 11.0465 6.13687 12.096 numMergedOcc 0
15 mol 198 unq 1 iso 0 dist 8.80787 9.9223 8.17562 11.0465 6.13687 3.4601 numMergedOcc 0
16 mol 284 unq 0 iso 0 dist 6.36106 10.5118 6.52085 4.16786 4.69611 6.53775 numMergedOcc 0
17 mol 284 unq 1 iso 0 dist 6.36106 15.5889 9.84174 4.16786 4.69611 13.4014 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 9.86256 12.4611 7.74312 14.9936 8.08382 3.66473 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.86256 12.4611 7.74312 14.9936 8.08382 3.66473 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 9.86256 12.4611 7.74312 14.9936 8.08382 3.66473 numMergedOcc 0
