0 mol 2 unq 0 iso 0 dist 7.99162 5.59831 6.35342 10.8851 5.24374 6.60948 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.54885 7.78176 7.14934 11.734 5.94149 6.40556 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.54885 7.78176 7.14934 9.44899 4.87741 5.272 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.81637 4.95437 7.84983 11.9175 7.71984 7.93406 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 5.8992 5.18488 6.7763 8.90372 7.73661 6.22956 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 8.85873 11.2532 6.36021 16.6744 8.3977 8.45308 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 9.9633 9.40358 7.21229 15.4173 7.92629 7.1891 numMergedOcc 0
7 mol 110 unq 1 iso 0 dist 9.9633 9.40358 7.21229 16.5204 9.86374 7.67702 numMergedOcc 0
8 mol 110 unq 2 iso 0 dist 7.77678 11.5698 5.25492 10.2745 4.65767 7.1891 numMergedOcc 0
9 mol 110 unq 3 iso 0 dist 7.77678 11.5698 5.25492 7.36326 5.33778 7.67702 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 6.34542 11.5209 8.42147 9.77669 4.41283 5.05141 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 8.04723 6.1397 8.0974 14.0307 16.8486 9.56963 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 8.04723 6.1397 8.0974 10.899 11.6817 5.95885 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 8.67271 7.70994 6.02561 10.9569 4.57422 5.4981 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 9.36732 7.21567 6.76923 11.3034 8.07956 8.62618 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 8.57514 8.21257 8.43584 9.63592 9.7129 7.9678 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 6.11505 5.03046 8.43584 5.64116 9.7129 7.9678 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.58471 15.9233 9.67457 13.5667 5.06314 8.14413 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 7.49412 11.7007 9.31246 11.7213 5.6375 6.02845 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.82778 12.7518 6.37342 10.8536 9.00069 5.62744 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 9.07206 5.7123 6.28512 14.4978 7.59549 9.23807 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 9.07206 5.7123 6.28512 5.87353 7.58851 8.49619 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 9.82717 14.401 8.71213 17.6586 12.5075 7.2491 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 8.33653 8.64319 8.71213 10.4227 12.5075 7.2491 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 6.44657 14.1417 8.71213 16.902 12.5075 7.2491 numMergedOcc 0
