0 mol 61 unq 0 iso 0 dist 6.56878 11.359 9.67403 6.90883 5.01022 14.3446 numMergedOcc 0
1 mol 61 unq 1 iso 0 dist 6.56878 10.9697 7.28917 6.90883 5.01022 4.91795 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.42102 14.6425 6.36178 15.0897 6.59232 7.4317 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.67853 10.9774 9.33202 14.3708 9.51347 12.4274 numMergedOcc 0
4 mol 83 unq 1 iso 0 dist 9.67853 5.07006 6.55004 14.3708 9.51347 11.1783 numMergedOcc 0
5 mol 83 unq 2 iso 0 dist 9.67853 7.44844 7.16614 14.3708 9.51347 14.9677 numMergedOcc 0
6 mol 83 unq 3 iso 0 dist 9.67853 9.4204 9.35188 14.3708 9.51347 18.2639 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 6.17537 3.97579 5.57712 8.53005 8.95491 4.98638 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 8.63253 5.57291 8.07962 10.3467 7.18097 5.65142 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 8.63253 6.91222 7.58908 10.3467 7.18097 6.51368 numMergedOcc 0
10 mol 108 unq 0 iso 0 dist 8.92763 11.7338 5.52402 14.7988 7.96745 10.5684 numMergedOcc 0
11 mol 108 unq 1 iso 0 dist 8.92763 11.7338 5.52402 5.65462 9.71442 13.7981 numMergedOcc 0
12 mol 108 unq 2 iso 0 dist 8.92763 11.7338 5.52402 14.0896 8.99379 5.69391 numMergedOcc 0
13 mol 108 unq 3 iso 0 dist 8.92763 4.89603 6.79804 14.7988 7.96745 14.1381 numMergedOcc 0
14 mol 108 unq 4 iso 0 dist 8.92763 4.89603 6.79804 5.65462 9.71442 9.46026 numMergedOcc 0
15 mol 108 unq 5 iso 0 dist 8.92763 4.89603 6.79804 14.0896 8.99379 11.3762 numMergedOcc 0
16 mol 151 unq 0 iso 0 dist 9.99307 5.45505 5.89907 8.09871 5.78631 7.48212 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 9.44094 12.4449 6.50727 10.8648 9.12641 6.35266 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 9.44094 16.4169 7.84826 10.8648 9.12641 10.3477 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 7.62438 14.6742 9.36753 8.07521 4.7359 6.83465 numMergedOcc 0
20 mol 270 unq 0 iso 0 dist 8.0831 8.5694 6.72681 9.59807 9.22297 4.60947 numMergedOcc 0
