0 mol 52 unq 0 iso 0 dist 5.95004 8.38301 5.43618 9.66329 6.84652 7.46764 numMergedOcc 0
1 mol 52 unq 1 iso 0 dist 8.38301 5.95004 5.43618 9.66329 7.46764 6.84652 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.84699 8.40844 5.47475 10.0721 6.4154 9.51458 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.84699 6.99156 5.05066 10.0721 6.4154 10.9127 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.40844 7.84699 5.47475 14.8445 9.67601 15.089 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.40844 6.99156 4.4628 14.8445 9.67601 11.9113 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 7.53504 8.66342 5.47475 13.2987 6.4154 9.51458 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 7.53504 7.21285 5.05066 13.2987 6.4154 10.9127 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 7.53504 6.95094 9.51715 13.2987 6.4154 15.54 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 8.66342 7.53504 5.47475 15.5344 9.67601 15.089 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 8.66342 7.21285 4.4628 15.5344 9.67601 11.9113 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 8.66342 6.95094 11.6754 15.5344 9.67601 18.1632 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 8.6728 9.36989 12.1484 5.54452 7.42204 13.3553 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 7.59973 9.61113 7.56811 12.7125 9.50209 11.9326 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.21999 7.94564 5.63574 6.63186 8.33489 10.0693 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 5.34451 9.74966 8.38946 9.8187 9.66935 11.5396 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 6.6175 9.87914 9.00126 9.6867 8.9891 11.5367 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 7.21636 7.99446 5.72609 5.58453 8.85948 11.7641 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 9.17063 9.99332 4.5403 9.61315 9.25763 9.63102 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 9.17063 7.13369 13.1862 9.61315 9.25763 11.7679 numMergedOcc 0
20 mol 173 unq 2 iso 0 dist 9.99332 9.17063 4.5403 9.61315 9.63102 9.25763 numMergedOcc 0
21 mol 173 unq 3 iso 0 dist 9.99332 7.13369 11.2682 9.61315 9.63102 11.7679 numMergedOcc 0
22 mol 199 unq 0 iso 0 dist 7.29716 8.80983 9.38427 6.30608 8.97577 12.1387 numMergedOcc 0
23 mol 211 unq 0 iso 0 dist 9.45365 7.14732 9.23863 13.1369 9.97733 15.6834 numMergedOcc 0
24 mol 211 unq 1 iso 0 dist 7.15386 9.63472 10.7154 9.91543 9.97733 18.4565 numMergedOcc 0
25 mol 211 unq 2 iso 0 dist 7.73993 5.42004 10.7154 13.4388 9.97733 18.4565 numMergedOcc 0
26 mol 224 unq 0 iso 0 dist 4.99301 6.36813 6.35724 5.69457 8.7868 4.64336 numMergedOcc 0
27 mol 224 unq 1 iso 0 dist 6.36813 4.99301 6.35724 5.69457 4.64336 8.7868 numMergedOcc 0
28 mol 224 unq 2 iso 0 dist 7.7163 9.2 5.75133 4.92261 8.60781 11.0076 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 5.68643 8.99974 4.94221 9.3038 9.36111 13.2808 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 5.68643 8.36043 6.01628 9.3038 9.36111 6.75233 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 8.36043 8.99974 7.65517 9.3038 6.75233 13.2808 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 8.36043 5.68643 6.01628 9.3038 6.75233 9.36111 numMergedOcc 0
33 mol 274 unq 4 iso 0 dist 9.96645 9.29005 19.0649 6.13137 5.12523 14.7267 numMergedOcc 0
34 mol 274 unq 5 iso 0 dist 9.96645 8.16746 17.8293 6.13137 5.12523 14.2841 numMergedOcc 0
35 mol 274 unq 6 iso 0 dist 9.29005 9.96645 19.0649 5.18671 5.42845 14.3188 numMergedOcc 0
36 mol 274 unq 7 iso 0 dist 9.29005 8.16746 5.09461 5.18671 5.42845 5.62484 numMergedOcc 0
37 mol 274 unq 8 iso 0 dist 8.16746 9.96645 17.8293 5.18671 5.62484 14.3188 numMergedOcc 0
38 mol 274 unq 9 iso 0 dist 8.16746 9.29005 5.09461 5.18671 5.62484 5.42845 numMergedOcc 0
39 mol 274 unq 10 iso 0 dist 9.2447 7.87268 12.0214 5.06306 5.12523 10.8604 numMergedOcc 0
40 mol 277 unq 0 iso 0 dist 9.42812 8.83777 11.4925 7.4578 6.73204 14.0316 numMergedOcc 0
41 mol 284 unq 0 iso 0 dist 7.80784 8.38071 5.50433 9.26331 9.1161 13.5097 numMergedOcc 0
42 mol 286 unq 0 iso 0 dist 8.30708 8.9718 5.58226 7.24769 9.10103 6.88301 numMergedOcc 0
43 mol 286 unq 1 iso 0 dist 8.9718 8.30708 5.58226 7.24769 6.88301 9.10103 numMergedOcc 0
