0 mol 2 unq 0 iso 0 dist 9.40823 5.31104 9.08872 8.66033 6.23988 9.74371 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.40823 10.2334 7.37296 14.1626 6.80804 6.15195 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 8.66033 5.31104 9.74371 9.40823 6.23988 9.08872 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 8.5163 7.7038 9.08872 11.2121 6.23988 9.74371 numMergedOcc 0
4 mol 2 unq 4 iso 0 dist 8.5163 5.40651 7.37296 10.3245 6.80804 6.15195 numMergedOcc 0
5 mol 2 unq 5 iso 0 dist 9.54324 9.97841 9.74371 13.6161 6.23988 9.08872 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 8.81871 16.368 8.0166 9.71959 5.63739 9.32945 numMergedOcc 0
7 mol 7 unq 1 iso 0 dist 8.81871 16.368 8.0166 14.8208 10.2796 9.90117 numMergedOcc 0
8 mol 7 unq 2 iso 0 dist 9.71959 16.368 9.32945 8.81871 5.63739 8.0166 numMergedOcc 0
9 mol 7 unq 3 iso 0 dist 9.71959 16.368 9.32945 14.8208 5.38328 9.90117 numMergedOcc 0
10 mol 14 unq 0 iso 0 dist 9.60834 4.49408 8.19687 9.11167 6.23746 5.71901 numMergedOcc 0
11 mol 14 unq 1 iso 0 dist 9.11167 4.49408 5.71901 9.60834 6.23746 8.19687 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 8.91858 12.7633 9.27355 11.6899 5.47475 5.39171 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 8.91858 12.7633 9.27355 7.5442 4.4628 8.60363 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 7.5442 12.7633 8.60363 11.6899 5.05066 5.39171 numMergedOcc 0
15 mol 73 unq 3 iso 0 dist 7.5442 12.7633 8.60363 8.91858 4.4628 9.27355 numMergedOcc 0
16 mol 130 unq 0 iso 0 dist 8.25442 5.65698 6.54338 9.57695 4.80422 9.39135 numMergedOcc 0
17 mol 130 unq 1 iso 0 dist 8.25442 4.61946 7.47653 11.6048 5.90718 8.50054 numMergedOcc 0
18 mol 130 unq 2 iso 0 dist 8.25442 4.61946 7.47653 9.57695 4.80422 8.97124 numMergedOcc 0
19 mol 130 unq 3 iso 0 dist 9.57695 5.65698 9.39135 8.25442 4.80422 6.54338 numMergedOcc 0
20 mol 130 unq 4 iso 0 dist 9.57695 4.61946 8.97124 11.6048 8.99904 8.50054 numMergedOcc 0
21 mol 130 unq 5 iso 0 dist 9.57695 4.61946 8.97124 8.25442 4.80422 7.47653 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 4.84604 6.53637 7.50126 10.5354 11.0817 5.12189 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 9.91507 4.92832 5.33543 10.3975 5.63574 7.85526 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 7.01007 8.21784 8.6609 10.6965 6.77498 6.21546 numMergedOcc 0
25 mol 175 unq 1 iso 0 dist 7.01007 8.21784 8.6609 12.0647 12.0951 6.03184 numMergedOcc 0
26 mol 199 unq 0 iso 0 dist 7.91016 14.6089 9.88917 14.7551 10.3162 9.56785 numMergedOcc 0
27 mol 199 unq 1 iso 0 dist 7.21813 11.6262 9.88917 9.74632 10.3162 9.56785 numMergedOcc 0
28 mol 199 unq 2 iso 0 dist 9.74632 11.6262 9.56785 7.21813 10.3162 9.88917 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 9.10711 10.8277 9.68829 14.7804 9.21051 9.085 numMergedOcc 0
30 mol 210 unq 0 iso 0 dist 8.87835 7.45619 6.24111 8.93859 9.07869 8.60412 numMergedOcc 0
31 mol 210 unq 1 iso 0 dist 8.87835 4.70332 9.00343 8.93859 9.07869 7.05535 numMergedOcc 0
32 mol 210 unq 2 iso 0 dist 9.54076 9.42733 6.24111 17.1824 9.07869 8.60412 numMergedOcc 0
33 mol 210 unq 3 iso 0 dist 9.54076 13.6553 9.00343 17.1824 9.07869 7.05535 numMergedOcc 0
34 mol 210 unq 4 iso 0 dist 8.93859 7.45619 8.60412 8.87835 9.07869 6.24111 numMergedOcc 0
35 mol 210 unq 5 iso 0 dist 8.93859 4.70332 7.05535 8.87835 9.07869 9.00343 numMergedOcc 0
36 mol 211 unq 0 iso 0 dist 8.47937 5.28889 9.8921 10.5645 8.59334 8.50841 numMergedOcc 0
37 mol 224 unq 0 iso 0 dist 7.73616 6.0185 5.97988 11.8883 8.07582 9.37276 numMergedOcc 0
38 mol 224 unq 1 iso 0 dist 7.73616 9.41461 9.08719 13.2281 11.6002 6.6537 numMergedOcc 0
39 mol 249 unq 0 iso 0 dist 8.09174 11.359 6.18866 9.08729 5.2966 9.3807 numMergedOcc 0
40 mol 249 unq 1 iso 0 dist 9.08729 11.359 9.3807 8.09174 5.2966 6.18866 numMergedOcc 0
41 mol 250 unq 0 iso 0 dist 9.68049 4.06429 8.38141 8.19924 5.01048 5.08366 numMergedOcc 0
42 mol 250 unq 1 iso 0 dist 9.68049 4.06429 8.38141 8.01457 12.269 8.18086 numMergedOcc 0
43 mol 250 unq 2 iso 0 dist 8.19924 4.06429 5.08366 9.68049 5.01048 8.38141 numMergedOcc 0
44 mol 250 unq 3 iso 0 dist 8.19924 4.06429 5.08366 8.01457 9.8248 8.18086 numMergedOcc 0
45 mol 250 unq 4 iso 0 dist 8.01457 4.06429 8.18086 9.68049 12.269 8.38141 numMergedOcc 0
46 mol 250 unq 5 iso 0 dist 8.01457 4.06429 8.18086 8.19924 9.8248 5.08366 numMergedOcc 0
47 mol 257 unq 0 iso 0 dist 5.81003 7.5301 6.51449 15.9098 11.6752 9.50221 numMergedOcc 0
48 mol 265 unq 0 iso 0 dist 9.97669 11.7587 4.03921 17.8101 13.1954 9.56472 numMergedOcc 0
49 mol 265 unq 1 iso 0 dist 9.97669 11.7587 4.03921 16.7978 7.82127 6.5072 numMergedOcc 0
50 mol 294 unq 0 iso 0 dist 6.075 7.71145 5.76337 5.27696 4.46072 9.39625 numMergedOcc 0
51 mol 294 unq 1 iso 0 dist 6.075 3.95468 8.60441 5.27696 4.46072 6.97558 numMergedOcc 0
52 mol 294 unq 2 iso 0 dist 5.27696 7.71145 9.39625 6.075 4.46072 5.76337 numMergedOcc 0
53 mol 294 unq 3 iso 0 dist 5.27696 3.95468 6.97558 6.075 4.46072 8.60441 numMergedOcc 0
