0 mol 16 unq 0 iso 0 dist 8.56826 4.77443 7.72142 8.69541 5.40044 8.47315 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 8.39722 5.23686 8.52824 13.9867 11.051 9.29873 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 6.50264 5.49864 9.31938 10.0378 6.90892 9.37957 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.73832 11.6727 7.02351 20.0533 13.6586 9.68526 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.73832 11.6727 7.02351 11.6749 10.3774 7.26679 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 6.73832 11.6727 7.02351 9.34779 4.15333 9.30776 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.46036 7.30364 4.85152 10.2803 11.1785 9.514 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.46036 7.30364 4.85152 6.30103 10.9352 7.84888 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.20574 12.1717 8.6728 13.7333 10.602 7.38759 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 4.84683 6.43211 9.61113 13.5476 13.9809 9.01767 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 4.84683 6.93587 7.59973 13.1257 10.3418 9.43411 numMergedOcc 0
11 mol 102 unq 2 iso 0 dist 4.84683 6.93587 7.59973 13.5476 13.9809 9.80678 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.41815 16.6797 8.592 12.0418 4.24853 7.25166 numMergedOcc 0
13 mol 114 unq 1 iso 0 dist 8.41815 16.6797 8.592 13.9868 9.52181 8.42445 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 7.77423 14.7064 8.26291 12.6111 5.25879 8.54461 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 7.77423 14.7064 8.26291 17.5478 10.9365 7.83619 numMergedOcc 0
16 mol 211 unq 0 iso 0 dist 9.49714 13.8833 7.73993 18.3694 11.6621 8.63308 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 9.40687 10.6403 5.69733 9.40003 5.68711 8.49704 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 6.19798 4.56782 7.10689 7.27481 5.01062 8.7347 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.27538 6.4556 4.99301 4.79841 5.25583 6.56437 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 8.27538 5.66462 6.36813 4.79841 5.25583 6.23882 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 9.35563 5.57706 8.19772 10.2586 4.36105 9.59213 numMergedOcc 0
22 mol 276 unq 0 iso 0 dist 7.07283 4.48428 7.35537 8.28881 7.16212 7.70061 numMergedOcc 0
23 mol 276 unq 1 iso 0 dist 7.07283 4.48428 7.35537 5.30976 9.58401 9.05218 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.06324 5.72978 8.66917 5.17586 5.31331 8.13489 numMergedOcc 0
25 mol 294 unq 0 iso 0 dist 8.1414 5.822 6.9719 12.0401 6.25471 9.06517 numMergedOcc 0
