0 mol 1 unq 0 iso 0 dist 5.55208 8.93702 6.28655 6.79192 8.83387 12.6414 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.5933 8.93702 10.1521 6.79192 9.85305 12.6414 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 6.60128 8.95573 9.45185 4.86477 7.30231 8.09187 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.09741 6.88603 12.1018 10.7721 7.30934 16.7995 numMergedOcc 0
4 mol 167 unq 0 iso 0 dist 9.15244 9.4422 11.0411 5.60897 8.88037 11.4453 numMergedOcc 0
5 mol 187 unq 0 iso 0 dist 9.469 9.25105 4.71837 9.53252 8.26077 9.87719 numMergedOcc 0
6 mol 220 unq 0 iso 0 dist 7.30288 5.13604 6.32132 5.11797 9.54857 9.43419 numMergedOcc 0
7 mol 220 unq 1 iso 0 dist 7.30288 5.13604 6.32132 5.32983 8.73456 9.92033 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 6.89242 6.31342 6.4725 15.3903 9.02494 11.9652 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 6.89242 6.31342 6.4725 12.2323 8.83641 14.4859 numMergedOcc 0
10 mol 236 unq 0 iso 0 dist 6.35418 7.05868 4.99523 12.1646 8.32786 11.4354 numMergedOcc 0
11 mol 236 unq 1 iso 0 dist 6.35418 7.05868 4.99523 3.2549 5.09952 7.58569 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 9.7462 7.96438 11.2863 15.977 8.35328 17.992 numMergedOcc 0
13 mol 260 unq 0 iso 0 dist 7.5129 9.50619 8.29529 12.1108 7.13397 14.7837 numMergedOcc 0
14 mol 260 unq 1 iso 0 dist 7.5129 9.50619 8.29529 12.7836 5.33278 10.3097 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 7.21215 9.15288 11.639 4.5731 9.20906 9.73748 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 7.21215 6.11795 10.8074 4.5731 9.20906 9.62847 numMergedOcc 0
17 mol 281 unq 0 iso 0 dist 6.60861 9.26654 6.93582 7.60311 7.82358 9.94612 numMergedOcc 0
18 mol 294 unq 0 iso 0 dist 8.79534 7.86196 14.8622 16.4938 9.32126 20.1392 numMergedOcc 0
19 mol 294 unq 1 iso 0 dist 8.79534 7.86196 14.8622 17.7564 9.38111 22.2308 numMergedOcc 0
20 mol 294 unq 2 iso 0 dist 8.79534 7.86196 14.8622 15.1788 9.14005 19.4615 numMergedOcc 0
