0 mol 24 unq 0 iso 0 dist 9.49404 8.06363 9.03541 8.74944 8.69288 14.3235 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.49404 8.06363 9.03541 4.80814 7.77964 10.5945 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 9.06787 18.2881 9.31516 9.58409 5.40489 10.8961 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 5.65006 13.2269 9.3711 10.0759 9.08825 12.2676 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.17687 5.61624 8.89939 4.9889 7.20211 9.48735 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 7.85265 13.0911 9.11206 12.8099 9.17843 5.01159 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 8.59002 15.6545 9.58666 7.60323 6.96745 14.9788 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 9.11877 5.77495 5.44814 12.9512 9.29944 12.4579 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 9.19254 10.4685 9.95076 9.64824 9.43904 5.09521 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.09756 6.28015 9.82338 5.565 8.5672 9.33116 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 7.44523 6.28015 7.99933 8.84505 5.67168 5.32701 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 7.49839 5.73453 7.7734 8.58664 5.67168 5.21837 numMergedOcc 0
12 mol 186 unq 3 iso 0 dist 7.49839 5.73453 7.7734 6.419 7.74579 5.52154 numMergedOcc 0
13 mol 186 unq 4 iso 0 dist 7.49839 5.73453 7.7734 6.27088 5.86483 7.51045 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 5.65314 8.66994 9.68213 4.26432 6.69042 12.4844 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 8.91548 6.08627 5.83021 4.10207 9.95026 5.84459 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 8.91548 6.08627 5.83021 6.97629 9.09594 4.25315 numMergedOcc 0
17 mol 206 unq 2 iso 0 dist 8.91548 10.645 9.18711 4.10207 9.95026 7.76853 numMergedOcc 0
18 mol 206 unq 3 iso 0 dist 8.91548 10.645 9.18711 6.97629 9.09594 4.89614 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 7.79613 4.86004 5.07975 10.415 8.14294 6.84149 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 9.48525 11.4962 9.0735 12.5148 9.3502 7.30721 numMergedOcc 0
21 mol 225 unq 1 iso 0 dist 9.48525 11.4962 9.0735 8.62768 9.34821 5.22792 numMergedOcc 0
22 mol 225 unq 2 iso 0 dist 9.48525 11.4962 9.0735 4.57447 6.46405 10.0058 numMergedOcc 0
23 mol 243 unq 0 iso 0 dist 7.42359 11.9134 8.07313 5.69077 8.30024 8.17555 numMergedOcc 0
24 mol 243 unq 1 iso 0 dist 7.42359 11.9134 8.07313 9.70906 8.20943 7.40657 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 8.20902 9.93994 8.18813 14.6762 7.16209 13.3706 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 8.20902 9.93994 8.18813 11.68 4.62936 12.1739 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 7.98589 11.3539 8.18813 6.40883 7.16209 13.3706 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 7.98589 11.3539 8.18813 6.79352 4.62936 12.1739 numMergedOcc 0
