0 mol 26 unq 0 iso 0 dist 7.90324 6.69874 5.56687 5.51158 4.04528 5.73363 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.35731 4.50032 6.02472 7.19406 6.70122 5.02642 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.16338 8.31625 7.546 9.89466 3.73413 9.27044 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 6.16338 8.16941 7.20403 9.89466 3.73413 8.98208 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 8.73268 11.4549 9.04661 8.4689 6.71593 5.47459 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.27601 4.65951 8.55826 6.8456 3.88006 5.82456 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.98622 11.2993 9.7113 11.3542 6.15789 6.65878 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.73325 17.4759 7.7461 17.6479 10.009 8.17814 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 9.73325 17.4759 7.7461 25.3618 15.9635 9.14434 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.06613 4.57124 5.99212 12.1214 4.13881 8.03695 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 8.80059 7.36888 5.24076 10.4499 6.62718 5.60956 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 9.70728 14.4364 8.14167 8.91036 5.04427 6.60418 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 8.06858 6.60813 6.80332 13.7865 9.39384 8.09185 numMergedOcc 0
13 mol 212 unq 1 iso 0 dist 8.06858 6.60813 6.80332 7.35349 4.69067 7.27225 numMergedOcc 0
14 mol 212 unq 2 iso 0 dist 8.06858 6.60813 6.80332 12.302 5.37854 8.14212 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 5.50061 4.84723 5.6297 11.1839 9.73806 8.48816 numMergedOcc 0
16 mol 241 unq 1 iso 0 dist 9.08025 5.02161 5.6297 13.2832 9.73806 8.48816 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 7.24253 14.7385 9.18477 12.2579 5.40441 8.6336 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.41653 10.6487 7.87648 16.03 10.318 8.43002 numMergedOcc 0
