0 mol 7 unq 0 iso 0 dist 8.88982 14.0137 5.72491 16.991 9.67164 8.0744 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 13.0722 7.88043 5.33843 5.99459 8.0744 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.8576 16.4052 8.80762 5.33843 5.99459 11.7002 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 8.51213 7.30279 7.55766 5.34733 5.65084 4.8604 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.80849 9.90348 6.72502 6.08283 8.09311 9.94429 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.80849 9.90348 6.72502 6.99919 9.05357 6.88355 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 6.00307 6.13982 6.90155 3.8857 4.79873 6.86525 numMergedOcc 0
7 mol 25 unq 1 iso 0 dist 6.00307 6.13982 6.90155 11.2808 9.48085 13.7717 numMergedOcc 0
8 mol 38 unq 0 iso 0 dist 9.70612 11.0716 7.57959 8.46463 9.19165 5.29787 numMergedOcc 0
9 mol 38 unq 1 iso 0 dist 9.70612 5.59494 7.05737 8.46463 9.19165 5.26748 numMergedOcc 0
10 mol 43 unq 0 iso 0 dist 8.99509 13.4933 8.44903 11.0512 6.66407 4.69849 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.63534 7.28582 4.79949 10.4541 9.85905 11.0792 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 7.63534 8.88157 7.27693 10.4541 9.85905 6.48293 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 6.47346 5.75556 8.03372 4.0844 5.58833 7.06894 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 7.14849 6.72936 4.92088 3.95924 9.11204 7.79894 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 8.63718 9.74054 4.92088 12.5927 9.11204 7.79894 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.16369 12.1694 7.24795 14.8867 8.73533 9.40383 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 7.09426 13.9257 9.83476 12.6481 7.2793 6.38897 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 7.09426 13.9257 9.83476 13.7919 9.51091 8.93258 numMergedOcc 0
19 mol 186 unq 3 iso 0 dist 7.09426 13.9257 9.83476 3.97751 7.85184 11.924 numMergedOcc 0
20 mol 186 unq 4 iso 0 dist 7.09426 7.15761 6.258 12.6481 7.2793 8.88593 numMergedOcc 0
21 mol 186 unq 5 iso 0 dist 7.09426 7.15761 6.258 13.7919 9.51091 8.7188 numMergedOcc 0
22 mol 186 unq 6 iso 0 dist 7.09426 7.15761 6.258 3.97751 7.85184 9.8366 numMergedOcc 0
23 mol 204 unq 0 iso 0 dist 6.20646 8.75405 6.85441 6.05253 7.9133 9.54203 numMergedOcc 0
24 mol 204 unq 1 iso 0 dist 6.73266 7.32929 6.85441 13.3588 7.9133 9.54203 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 9.85348 4.58065 8.06216 9.15328 7.33709 7.4492 numMergedOcc 0
26 mol 218 unq 1 iso 0 dist 9.85348 10.6818 5.76954 9.15328 7.33709 6.57708 numMergedOcc 0
27 mol 218 unq 2 iso 0 dist 9.85348 12.85 6.29511 9.15328 7.33709 13.4147 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 8.9413 14.1265 7.5366 14.075 7.81215 11.0592 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 4.91961 8.3084 7.5366 4.84686 7.81215 11.0592 numMergedOcc 0
30 mol 236 unq 0 iso 0 dist 5.99137 10.968 8.50331 13.9834 9.3206 5.59363 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 5.99187 8.22473 5.64181 13.6867 9.08509 6.94907 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 9.93378 8.22473 7.61393 13.7872 9.06592 9.9447 numMergedOcc 0
33 mol 257 unq 0 iso 0 dist 8.95261 14.4618 9.95546 3.84196 8.83833 15.1307 numMergedOcc 0
34 mol 257 unq 1 iso 0 dist 7.80336 10.369 9.95546 5.95711 8.83833 15.1307 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 6.70123 5.16567 6.57903 15.3157 9.57499 14.6871 numMergedOcc 0
