0 mol 7 unq 0 iso 0 dist 5.51421 4.7739 5.99459 3.52338 7.78327 7.00508 13.5184 12.2041 9.67164 14.0084 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 4.88613 4.99692 8.96727 6.09663 7.17488 10.5853 6.36193 4.81926 9.22598 9.9105 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.06168 10.8798 5.61588 15.6688 8.62079 10.0644 15.4463 8.07446 5.5087 7.37171 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.06168 13.7267 7.83244 15.6688 8.62079 12.1501 15.4463 8.07446 6.08682 7.37171 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.67532 10.8441 5.61588 8.22845 8.62079 10.0644 12.1964 8.07446 5.5087 7.37171 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.67532 15.2203 7.83244 8.22845 8.62079 12.1501 12.1964 8.07446 6.08682 7.37171 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.23023 13.8703 6.85523 15.9532 7.91148 6.99884 13.6324 7.19663 8.65848 12.2138 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.23023 13.8703 6.85523 14.6188 6.59794 3.75261 13.6324 7.19663 8.65848 10.167 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 9.23023 13.8703 6.85523 15.1992 8.34957 10.6388 13.6324 7.19663 8.65848 13.9695 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.72689 10.0429 7.80898 3.48087 9.07128 9.11654 17.1552 12.1547 7.51139 16.5543 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 9.72689 10.0429 7.80898 10.0091 6.65615 10.8983 17.1552 12.1547 7.51139 16.665 numMergedOcc 0
11 mol 88 unq 2 iso 0 dist 7.74197 11.151 7.80898 12.4888 9.07128 9.11654 14.2965 12.1547 7.51139 16.5543 numMergedOcc 0
12 mol 88 unq 3 iso 0 dist 7.74197 11.151 7.80898 6.15983 6.65615 10.8983 14.2965 12.1547 7.51139 16.665 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.58911 17.3349 8.59874 3.55808 9.70481 18.0236 9.86845 6.01247 9.76212 11.8368 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.84952 9.77747 9.01624 3.59953 8.29467 11.4645 13.0935 11.5866 5.05973 14.7884 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 8.3337 17.2264 9.10817 3.70636 9.23086 17.435 13.2564 5.43601 6.86828 13.9122 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 7.73315 3.5359 7.33709 14.9642 7.84952 13.5381 7.0843 4.72474 8.75536 11.8692 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 7.73315 3.5359 7.33709 14.9642 7.84952 13.5381 6.9398 5.61978 6.67404 12.5146 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.96343 6.17642 5.46926 7.9169 7.42932 5.9732 8.51931 7.69449 9.57499 12.762 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 8.96343 6.17642 5.46926 7.9169 7.42932 5.9732 9.71491 7.08227 8.9682 4.9764 numMergedOcc 0
20 mol 277 unq 2 iso 0 dist 8.96343 8.24206 5.13913 7.9169 7.42932 3.79766 9.71491 7.08227 6.92711 4.9764 numMergedOcc 0
21 mol 277 unq 3 iso 0 dist 9.29635 12.2421 8.9682 7.31817 4.9764 5.9732 17.8158 11.8268 9.57499 12.762 numMergedOcc 0
22 mol 277 unq 4 iso 0 dist 9.29635 12.2421 8.9682 7.31817 4.9764 5.9732 14.3464 7.08227 5.46926 7.42932 numMergedOcc 0
23 mol 277 unq 5 iso 0 dist 9.29635 12.2421 8.9682 3.91224 6.36559 8.61922 17.8158 11.8268 9.57499 14.7874 numMergedOcc 0
24 mol 277 unq 6 iso 0 dist 9.29635 12.2421 8.9682 3.91224 6.36559 8.61922 14.3464 7.08227 5.46926 10.5562 numMergedOcc 0
25 mol 277 unq 7 iso 0 dist 9.29635 10.9521 6.92711 7.31817 4.9764 3.79766 14.3464 7.08227 5.13913 7.42932 numMergedOcc 0
26 mol 277 unq 8 iso 0 dist 9.29635 10.9521 6.92711 3.91224 6.36559 7.07613 14.3464 7.08227 5.13913 10.5562 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.20416 12.3704 8.38121 3.64117 6.69619 12.1704 18.2037 11.8061 9.90967 17.2804 numMergedOcc 0
28 mol 292 unq 1 iso 0 dist 9.20416 12.3704 8.38121 7.30677 4.49592 11.9106 18.2037 11.8061 9.90967 16.1146 numMergedOcc 0
29 mol 292 unq 2 iso 0 dist 7.53641 15.5666 8.38121 6.97445 6.69619 12.1704 16.8329 11.8061 9.90967 17.2804 numMergedOcc 0
30 mol 292 unq 3 iso 0 dist 7.53641 15.5666 8.38121 5.33412 4.49592 11.9106 16.8329 11.8061 9.90967 16.1146 numMergedOcc 0
