0 mol 0 unq 0 iso 0 dist 6.99594 12.7893 7.92928 3.68241 5.75315 11.2254 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.99594 5.66453 7.48645 3.68241 5.75315 6.90471 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.77049 5.3866 9.82483 9.99243 9.81658 8.17486 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.95341 6.49896 9.82483 12.0088 9.81658 8.17486 numMergedOcc 0
4 mol 13 unq 0 iso 0 dist 9.18487 10.8881 9.11447 6.54276 7.98465 8.85788 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.62693 17.6797 9.25649 5.23054 5.84066 14.3725 numMergedOcc 0
6 mol 26 unq 1 iso 0 dist 8.62693 13.889 9.36104 5.23054 5.84066 11.3426 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 8.91418 4.15148 5.52067 9.00425 7.29079 7.20383 numMergedOcc 0
8 mol 41 unq 1 iso 0 dist 6.0961 7.51317 5.52067 12.6048 7.29079 7.20383 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 5.67098 7.39536 5.86571 6.24306 9.35784 9.20886 numMergedOcc 0
10 mol 56 unq 1 iso 0 dist 8.58218 11.4735 5.86571 9.63592 9.35784 9.20886 numMergedOcc 0
11 mol 62 unq 0 iso 0 dist 8.84323 5.0413 9.87677 5.46563 9.1062 6.35287 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 8.95838 7.58689 9.05798 5.99531 6.55202 9.75037 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 8.95838 7.58689 9.05798 11.2265 9.08536 13.2984 numMergedOcc 0
14 mol 119 unq 2 iso 0 dist 8.95838 5.47002 5.85818 5.99531 6.55202 6.71103 numMergedOcc 0
15 mol 119 unq 3 iso 0 dist 8.95838 5.47002 5.85818 11.2265 9.08536 6.29394 numMergedOcc 0
16 mol 119 unq 4 iso 0 dist 9.47892 9.21153 9.05798 13.9667 6.55202 9.75037 numMergedOcc 0
17 mol 119 unq 5 iso 0 dist 9.47892 9.21153 9.05798 15.453 9.08536 13.2984 numMergedOcc 0
18 mol 119 unq 6 iso 0 dist 9.47892 13.8865 5.85818 13.9667 6.55202 6.71103 numMergedOcc 0
19 mol 119 unq 7 iso 0 dist 9.47892 13.8865 5.85818 15.453 9.08536 6.29394 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.43335 5.91006 8.1582 5.36037 7.05845 3.75378 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 9.43335 10.9939 7.88655 5.36037 7.05845 9.30534 numMergedOcc 0
22 mol 143 unq 2 iso 0 dist 9.9492 14.2311 8.1582 15.3503 7.05845 3.75378 numMergedOcc 0
23 mol 143 unq 3 iso 0 dist 9.9492 9.32969 7.88655 15.3503 7.05845 9.30534 numMergedOcc 0
24 mol 173 unq 0 iso 0 dist 9.56248 13.638 7.54706 15.8873 8.62366 9.35572 numMergedOcc 0
25 mol 173 unq 1 iso 0 dist 9.56248 13.638 7.54706 14.9274 9.44973 5.74438 numMergedOcc 0
26 mol 173 unq 2 iso 0 dist 9.56248 13.638 7.54706 9.35913 6.52508 8.43374 numMergedOcc 0
27 mol 197 unq 0 iso 0 dist 8.32685 6.35266 9.71865 15.7632 9.27218 15.0713 numMergedOcc 0
28 mol 197 unq 1 iso 0 dist 6.74777 10.3477 9.71865 15.6628 9.27218 15.0713 numMergedOcc 0
29 mol 197 unq 2 iso 0 dist 9.62514 13.7046 9.71865 18.7224 9.27218 15.0713 numMergedOcc 0
30 mol 214 unq 0 iso 0 dist 9.39099 6.83037 7.2498 9.75492 9.58372 11.6757 numMergedOcc 0
31 mol 218 unq 0 iso 0 dist 7.90156 10.8118 9.67381 11.2254 8.61306 13.7733 numMergedOcc 0
32 mol 218 unq 1 iso 0 dist 7.90156 12.2629 6.61099 11.2254 8.61306 13.0451 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 9.94175 11.1472 8.6597 10.2069 9.38131 4.14399 numMergedOcc 0
34 mol 238 unq 1 iso 0 dist 8.81534 13.5907 8.6597 16.1646 9.38131 4.14399 numMergedOcc 0
35 mol 238 unq 2 iso 0 dist 9.46582 12.2456 7.61203 5.17342 7.39547 8.5378 numMergedOcc 0
36 mol 239 unq 0 iso 0 dist 5.66792 4.52384 5.45844 11.2891 9.74902 7.16787 numMergedOcc 0
37 mol 248 unq 0 iso 0 dist 8.97536 5.82647 8.42446 3.67057 8.07962 8.10311 numMergedOcc 0
38 mol 259 unq 0 iso 0 dist 9.53092 6.20003 6.39918 9.92544 8.84648 4.67584 numMergedOcc 0
39 mol 259 unq 1 iso 0 dist 9.53092 6.20003 6.39918 12.9171 6.23661 7.32929 numMergedOcc 0
40 mol 273 unq 0 iso 0 dist 9.79283 5.62645 6.94131 12.2057 9.35749 6.87067 numMergedOcc 0
41 mol 273 unq 1 iso 0 dist 9.79283 8.08262 9.84628 12.2057 9.35749 5.81024 numMergedOcc 0
