0 mol 4 unq 0 iso 0 dist 8.12032 9.61247 11.0362 8.00865 11.4725 7.45762 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 5.07365 8.89682 4.37718 6.67704 6.44044 10.4533 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 5.07365 7.12013 4.88331 6.19304 5.31805 8.43877 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 9.98444 9.81466 4.76459 5.75355 8.98098 6.78285 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 4.54428 6.10175 8.97716 9.57335 10.068 11.14 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 4.54428 6.10175 8.97716 8.60653 10.6382 7.93241 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.90823 8.06263 5.62638 8.87151 4.92112 6.99666 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 6.20207 8.06263 6.88473 8.87151 11.8868 6.99666 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.80347 3.59451 7.62019 9.40173 14.6729 7.43547 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.83602 7.26463 5.91268 8.61574 13.2234 13.6411 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 7.55428 7.26463 10.0673 8.61574 5.53673 13.6411 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 9.12773 5.50364 7.31861 5.43662 10.5805 4.17212 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 9.12773 8.7301 4.55152 5.43662 10.5805 9.64263 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 8.72148 9.04176 6.34446 6.40435 3.98813 5.0315 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 8.7192 9.04176 10.6517 6.40435 6.29145 5.0315 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 9.21361 7.8316 4.62508 6.74625 10.5679 7.03654 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 9.21361 9.96759 12.8156 6.74625 10.5679 4.33786 numMergedOcc 0
17 mol 224 unq 2 iso 0 dist 9.60784 7.8316 5.88589 6.74625 4.63072 7.03654 numMergedOcc 0
18 mol 224 unq 3 iso 0 dist 9.60784 9.96759 7.47545 6.74625 4.63072 4.33786 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.01934 4.21935 5.39741 9.25097 5.67269 5.51771 numMergedOcc 0
