0 mol 4 unq 0 iso 0 dist 7.53929 6.22303 6.82441 8.60134 3.25279 9.06421 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.12062 9.3613 11.042 5.39587 13.3334 9.0284 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.12062 9.3613 11.042 6.47252 8.73415 14.6063 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.35249 7.32436 9.5104 6.94712 6.10822 5.17091 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 5.24284 7.65981 5.54298 6.68114 3.82947 8.3816 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.75708 9.23755 6.17006 7.10218 6.7906 4.93697 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.35364 5.84349 12.2707 7.84956 10.5689 5.64279 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 9.35364 5.84349 12.2707 8.57607 17.1595 8.32734 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 9.35364 5.84349 12.2707 6.1991 15.0045 4.79063 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 9.35364 5.84349 12.2707 5.96246 10.1179 4.05985 numMergedOcc 0
10 mol 103 unq 0 iso 0 dist 9.71805 6.88956 8.31877 5.62245 6.28696 6.86277 numMergedOcc 0
11 mol 103 unq 1 iso 0 dist 4.9418 6.88956 4.36597 5.62245 3.86836 6.86277 numMergedOcc 0
12 mol 103 unq 2 iso 0 dist 5.7953 6.88956 5.3449 5.62245 8.52805 6.86277 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 5.32517 7.94925 10.3732 6.78833 5.62774 9.41812 numMergedOcc 0
14 mol 128 unq 1 iso 0 dist 7.6275 7.94925 9.77148 6.78833 4.98024 9.41812 numMergedOcc 0
15 mol 128 unq 2 iso 0 dist 7.4738 7.94925 11.4636 6.78833 6.84628 9.41812 numMergedOcc 0
16 mol 128 unq 3 iso 0 dist 8.88867 7.94925 3.93522 6.78833 8.84157 9.41812 numMergedOcc 0
17 mol 128 unq 4 iso 0 dist 7.04282 7.94925 5.16811 6.78833 4.99095 9.41812 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 8.78 5.19029 7.01552 8.8639 8.60388 7.17096 numMergedOcc 0
19 mol 133 unq 1 iso 0 dist 8.78 5.19029 7.01552 7.32009 10.0489 7.88526 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 9.51189 8.42226 7.05604 6.04336 9.03587 5.74718 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 9.51189 8.42226 7.05604 9.00537 12.4735 5.85073 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 8.51112 8.3941 12.1909 8.08491 3.58901 13.7639 numMergedOcc 0
23 mol 204 unq 0 iso 0 dist 9.19343 6.58174 7.51586 7.59666 4.98276 5.9546 numMergedOcc 0
24 mol 204 unq 1 iso 0 dist 9.19343 6.58174 7.51586 6.51936 3.72636 5.9943 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 8.31187 8.05254 4.75777 8.30771 14.2431 15.7562 numMergedOcc 0
26 mol 240 unq 0 iso 0 dist 8.96064 7.84314 9.80287 7.78879 6.19079 5.79131 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 5.77107 4.49395 6.37482 7.12723 8.02755 5.62841 numMergedOcc 0
