0 mol 12 unq 0 iso 0 dist 5.44478 7.4036 4.40652 11.6972 10.6393 6.96422 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 5.97418 5.39827 9.89377 6.35361 9.46217 7.46994 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 9.72716 7.25041 10.8154 5.40087 13.7391 9.52519 numMergedOcc 0
3 mol 87 unq 0 iso 0 dist 5.92576 7.14461 6.57984 5.75754 10.1385 7.2268 numMergedOcc 0
4 mol 87 unq 1 iso 0 dist 5.92576 7.14461 6.57984 7.55769 7.2668 8.31175 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 9.52282 8.22984 10.0156 12.1174 12.0659 7.09065 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 6.6514 7.93807 7.33075 6.77802 9.72291 7.80054 numMergedOcc 0
7 mol 189 unq 0 iso 0 dist 8.81184 7.45329 6.41248 5.79318 7.65477 9.33695 numMergedOcc 0
8 mol 189 unq 1 iso 0 dist 8.81184 7.45329 6.41248 4.88868 8.2926 6.31466 numMergedOcc 0
9 mol 189 unq 2 iso 0 dist 9.71306 7.45329 10.6364 5.79318 13.8432 9.33695 numMergedOcc 0
10 mol 189 unq 3 iso 0 dist 9.71306 7.45329 10.6364 4.88868 9.69971 6.31466 numMergedOcc 0
11 mol 189 unq 4 iso 0 dist 9.20296 7.45329 12.7664 5.79318 14.9509 9.33695 numMergedOcc 0
12 mol 189 unq 5 iso 0 dist 9.20296 7.45329 12.7664 4.88868 12.8885 6.31466 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 9.09371 9.84311 13.3228 13.1968 16.9053 7.57454 numMergedOcc 0
14 mol 227 unq 1 iso 0 dist 9.09371 8.85568 6.10844 5.31715 11.7694 9.28891 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.27377 8.70383 10.9823 3.494 11.3493 9.58354 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 9.73281 9.00866 8.60531 13.4991 14.891 8.94909 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 5.00402 7.37358 6.69582 10.1998 13.5918 9.24367 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 7.28238 5.94224 5.64774 6.63358 11.4162 6.8972 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 7.3389 5.94224 5.61995 6.63358 7.10557 6.8972 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 4.66252 9.52718 13.0167 9.81184 14.3165 5.59555 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 4.66252 9.52718 13.0167 9.81184 14.3165 5.59555 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 4.66252 9.52718 13.0167 9.81184 14.3165 5.59555 numMergedOcc 0
