0 mol 1 unq 0 iso 0 dist 5.55208 8.47429 4.49401 6.79192 8.83387 8.15672 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.5933 8.47429 5.72763 6.79192 9.85305 8.15672 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.62742 9.42607 4.54527 13.2938 9.76233 9.07476 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 9.62742 6.20956 4.44069 13.2938 9.76233 9.94905 numMergedOcc 0
4 mol 18 unq 0 iso 0 dist 7.50364 9.7814 4.76553 12.4739 7.30231 11.3419 numMergedOcc 0
5 mol 18 unq 1 iso 0 dist 6.60128 9.4649 4.76553 4.86477 7.30231 11.3419 numMergedOcc 0
6 mol 18 unq 2 iso 0 dist 6.60128 6.45965 10.8382 4.86477 7.30231 6.09533 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 6.74134 7.98824 3.80683 9.38492 9.06957 12.6801 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 6.74134 9.42329 6.77296 9.38492 9.06957 15.5099 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.50734 7.92498 14.4003 5.70681 6.38269 11.0815 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 8.50734 7.92498 14.4003 5.08157 7.11196 11.8871 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.15244 9.08229 4.74884 5.60897 8.88037 6.10021 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 9.15244 7.99057 6.44271 5.60897 8.88037 11.0561 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 7.642 8.11268 11.2473 5.73931 6.18165 10.9108 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.97162 9.51189 6.59916 8.81652 8.94445 14.1367 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 7.30288 9.39546 9.92692 5.11797 9.54857 14.1101 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 7.30288 9.39546 9.92692 5.32983 8.73456 14.4511 numMergedOcc 0
17 mol 220 unq 2 iso 0 dist 7.30288 4.17978 6.85536 5.11797 9.54857 9.19289 numMergedOcc 0
18 mol 220 unq 3 iso 0 dist 7.30288 4.17978 6.85536 5.32983 8.73456 8.60252 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 6.35418 6.54859 7.34037 12.1646 8.32786 11.2757 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 6.35418 6.54859 7.34037 3.2549 5.09952 8.69334 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 7.5129 7.90537 11.113 12.1108 7.13397 17.4567 numMergedOcc 0
22 mol 260 unq 1 iso 0 dist 7.5129 7.90537 11.113 12.7836 5.33278 14.7696 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 6.55498 9.33149 7.62941 13.5711 8.88717 9.59733 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 7.38219 9.33149 11.4179 13.5711 9.84651 9.59733 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 9.1299 8.35178 8.5724 11.9069 7.96707 15.74 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.1299 8.35178 8.5724 11.9069 7.96707 15.74 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.1299 8.35178 8.5724 11.9069 7.96707 15.74 numMergedOcc 0
28 mol 292 unq 0 iso 0 dist 6.59906 7.60019 12.2904 6.13654 7.61675 13.5939 numMergedOcc 0
29 mol 292 unq 1 iso 0 dist 7.1839 7.60019 4.49811 7.34358 4.97488 9.01115 numMergedOcc 0
