0 mol 7 unq 0 iso 0 dist 6.36911 9.68596 13.0969 5.03847 9.97624 6.14469 9.0379 13.2603 6.7985 8.43473 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.29358 5.89412 6.19131 9.75966 6.50647 6.03257 11.0528 10.2062 7.07399 4.39605 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 6.20943 8.40416 11.4087 10.943 9.85134 19.1389 7.67038 7.82528 7.75618 15.119 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 6.20943 8.40416 11.4087 4.64838 5.82366 9.95212 7.67038 7.82528 7.75618 4.97119 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.82528 7.75618 11.4087 15.119 9.85134 19.1389 7.67038 6.20943 8.40416 10.943 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 7.82528 7.75618 11.4087 4.97119 5.82366 9.95212 7.67038 6.20943 8.40416 4.64838 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 8.58657 6.41423 5.90856 13.0631 8.19695 13.4008 5.80928 9.58539 6.41575 13.8916 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 8.58657 6.41423 5.90856 7.08342 7.02548 9.95212 5.80928 9.58539 6.41575 9.74255 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 8.63333 9.92355 12.0055 10.2049 9.11258 10.2007 5.30792 11.5023 5.93884 9.95364 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 8.63333 9.92355 12.0055 10.2049 9.11258 10.2007 5.35073 8.89374 7.68678 5.49591 numMergedOcc 0
10 mol 58 unq 2 iso 0 dist 8.89374 7.68678 12.0055 5.49591 9.11258 10.2007 5.35073 8.63333 9.92355 10.2049 numMergedOcc 0
11 mol 58 unq 3 iso 0 dist 8.89374 7.68678 12.0055 5.49591 9.11258 10.2007 4.81926 11.5023 5.93884 9.95364 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.6355 7.80532 14.1488 5.71679 8.73604 6.40575 5.79898 12.0514 5.83771 4.60632 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 7.13543 7.99195 7.23063 5.77299 6.32777 8.86197 8.88798 10.7636 6.2479 8.04639 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 7.13543 7.99195 7.23063 5.77299 6.32777 8.86197 12.6324 13.1996 6.22122 13.0409 numMergedOcc 0
15 mol 181 unq 2 iso 0 dist 4.93785 9.39829 7.30555 7.77758 7.05653 11.8933 8.85576 10.1232 6.41453 12.5387 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 6.2188 7.10413 9.78181 6.56633 11.5589 9.40808 12.5452 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 5.65339 6.21292 7.96337 7.77516 6.54825 6.94789 8.31875 10.4621 6.36341 5.5163 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 5.65339 6.21292 7.96337 7.77516 6.54825 6.94789 4.53064 9.96742 9.21736 11.7254 numMergedOcc 0
19 mol 235 unq 2 iso 0 dist 5.65339 6.95126 4.29892 7.77516 6.54825 10.7602 9.89669 10.7117 9.55668 14.7526 numMergedOcc 0
20 mol 235 unq 3 iso 0 dist 9.58736 9.55668 13.128 15.6327 7.31773 17.8712 9.89669 12.3562 6.95126 14.7904 numMergedOcc 0
21 mol 235 unq 4 iso 0 dist 9.43058 9.21736 17.5445 10.632 7.31773 18.395 10.5547 19.8728 6.36341 20.4611 numMergedOcc 0
22 mol 235 unq 5 iso 0 dist 9.43058 9.21736 17.5445 10.632 7.31773 18.395 4.53064 12.3562 6.21292 14.7904 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 10.7081 8.09718 10.6756 5.6348 8.09066 7.02333 12.2874 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 6.05141 8.94014 11.5793 10.7081 8.09718 10.6756 8.87326 7.2766 8.67864 10.4017 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 6.05141 8.94014 11.5793 5.50308 6.73446 5.92374 5.6348 8.09066 7.02333 7.11984 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 6.05141 8.94014 11.5793 5.50308 6.73446 5.92374 8.87326 7.2766 8.67864 7.95232 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 8.14172 7.02333 4.38002 12.2874 8.90076 10.6756 5.6348 10.6978 8.94014 10.7081 numMergedOcc 0
28 mol 238 unq 5 iso 0 dist 8.14172 7.02333 4.38002 12.2874 8.90076 10.6756 5.31152 6.77463 8.67864 10.4017 numMergedOcc 0
29 mol 238 unq 6 iso 0 dist 8.14172 7.02333 4.38002 7.11984 6.62002 5.92374 5.6348 10.6978 8.94014 5.50308 numMergedOcc 0
30 mol 238 unq 7 iso 0 dist 8.14172 7.02333 4.38002 7.11984 6.62002 5.92374 5.31152 6.77463 8.67864 7.95232 numMergedOcc 0
31 mol 238 unq 8 iso 0 dist 8.09066 7.02333 11.5793 12.2874 8.09718 10.6756 5.6348 6.05141 8.94014 10.7081 numMergedOcc 0
32 mol 238 unq 9 iso 0 dist 8.09066 7.02333 11.5793 12.2874 8.09718 10.6756 5.31152 7.2766 8.67864 10.4017 numMergedOcc 0
33 mol 238 unq 10 iso 0 dist 8.09066 7.02333 11.5793 7.11984 6.73446 5.92374 5.6348 6.05141 8.94014 5.50308 numMergedOcc 0
34 mol 238 unq 11 iso 0 dist 8.09066 7.02333 11.5793 7.11984 6.73446 5.92374 5.31152 7.2766 8.67864 7.95232 numMergedOcc 0
35 mol 238 unq 12 iso 0 dist 6.77463 8.67864 4.38002 10.4017 8.90076 10.6756 8.87326 10.6978 8.94014 10.7081 numMergedOcc 0
36 mol 238 unq 13 iso 0 dist 6.77463 8.67864 4.38002 10.4017 8.90076 10.6756 5.31152 8.14172 7.02333 12.2874 numMergedOcc 0
37 mol 238 unq 14 iso 0 dist 6.77463 8.67864 4.38002 7.95232 6.62002 5.92374 8.87326 10.6978 8.94014 5.50308 numMergedOcc 0
38 mol 238 unq 15 iso 0 dist 6.77463 8.67864 4.38002 7.95232 6.62002 5.92374 5.31152 8.14172 7.02333 7.11984 numMergedOcc 0
39 mol 238 unq 16 iso 0 dist 7.2766 8.67864 11.5793 10.4017 8.09718 10.6756 8.87326 6.05141 8.94014 10.7081 numMergedOcc 0
40 mol 238 unq 17 iso 0 dist 7.2766 8.67864 11.5793 10.4017 8.09718 10.6756 5.31152 8.09066 7.02333 12.2874 numMergedOcc 0
41 mol 238 unq 18 iso 0 dist 7.2766 8.67864 11.5793 7.95232 6.73446 5.92374 8.87326 6.05141 8.94014 5.50308 numMergedOcc 0
42 mol 238 unq 19 iso 0 dist 7.2766 8.67864 11.5793 7.95232 6.73446 5.92374 5.31152 8.09066 7.02333 7.11984 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 9.19234 9.45514 12.625 5.64601 9.20749 10.083 10.501 14.4703 7.46394 14.3613 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 9.19234 9.45514 12.625 5.64601 9.20749 10.083 11.7196 17.725 8.91672 10.0554 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 9.19234 9.45514 12.625 5.64601 9.20749 10.083 6.828 14.3124 7.1729 10.5941 numMergedOcc 0
46 mol 274 unq 3 iso 0 dist 9.19234 6.39866 4.60275 5.64601 9.20749 9.16942 11.3308 12.5979 8.52587 16.3619 numMergedOcc 0
