0 mol 18 unq 0 iso 0 dist 7.23594 5.03451 10.0997 11.1909 17.5784 9.7728 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 6.05043 9.64287 4.23405 11.1228 9.17862 7.97266 numMergedOcc 0
2 mol 123 unq 0 iso 0 dist 8.87148 9.85144 6.21159 6.90284 9.99727 7.41568 numMergedOcc 0
3 mol 123 unq 1 iso 0 dist 9.26057 6.60464 6.21159 4.43198 9.99727 7.41568 numMergedOcc 0
4 mol 167 unq 0 iso 0 dist 6.64164 9.5648 12.8624 14.4262 19.0933 8.0697 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 8.08787 7.93815 4.63377 9.19336 8.8508 7.00382 numMergedOcc 0
6 mol 213 unq 0 iso 0 dist 6.82185 7.86605 4.71943 7.67515 7.22234 5.90026 numMergedOcc 0
7 mol 213 unq 1 iso 0 dist 6.82185 7.86605 4.71943 6.97521 5.86501 8.86496 numMergedOcc 0
8 mol 213 unq 2 iso 0 dist 6.82881 7.86605 3.62097 7.67515 8.48081 5.90026 numMergedOcc 0
9 mol 213 unq 3 iso 0 dist 6.82881 7.86605 3.62097 6.97521 10.1705 8.86496 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 9.22576 8.08382 6.68639 13.5638 15.8172 9.14217 numMergedOcc 0
11 mol 288 unq 0 iso 0 dist 9.22576 8.08382 6.68639 13.5638 15.8172 9.14217 numMergedOcc 0
12 mol 289 unq 0 iso 0 dist 9.22576 8.08382 6.68639 13.5638 15.8172 9.14217 numMergedOcc 0
13 mol 294 unq 0 iso 0 dist 9.6958 5.00754 9.80923 4.9798 11.5042 4.83062 numMergedOcc 0
14 mol 294 unq 1 iso 0 dist 9.6958 5.00754 9.80923 6.13274 15.5244 8.65363 numMergedOcc 0
15 mol 294 unq 2 iso 0 dist 9.6958 6.70519 14.2286 4.9798 11.5042 5.18334 numMergedOcc 0
16 mol 294 unq 3 iso 0 dist 9.6958 6.70519 14.2286 6.13274 15.5244 6.44588 numMergedOcc 0
