0 mol 28 unq 0 iso 0 dist 5.98169 7.98722 8.66738 11.1462 9.17482 16.0786 numMergedOcc 0
1 mol 107 unq 0 iso 0 dist 4.99934 11.7698 7.2168 9.12502 7.82303 8.84464 numMergedOcc 0
2 mol 114 unq 0 iso 0 dist 8.18356 6.20949 7.4113 4.87086 6.4569 9.20674 numMergedOcc 0
3 mol 114 unq 1 iso 0 dist 8.18356 15.013 8.53631 4.87086 6.4569 12.0204 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 6.91039 15.9297 9.99012 12.3932 7.22 6.36527 numMergedOcc 0
5 mol 143 unq 1 iso 0 dist 6.91039 4.14823 5.33772 12.3932 7.22 11.1239 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 9.3776 6.27142 9.07315 11.3807 9.70575 5.49264 numMergedOcc 0
7 mol 152 unq 1 iso 0 dist 7.71959 6.30491 6.68265 9.29952 9.48674 12.755 numMergedOcc 0
8 mol 152 unq 2 iso 0 dist 7.71959 4.48776 7.78842 9.29952 9.48674 6.79236 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 8.88037 11.2395 8.06817 4.3464 8.23119 12.3827 numMergedOcc 0
10 mol 182 unq 0 iso 0 dist 8.10542 7.44165 6.55146 10.9549 9.19506 13.9827 numMergedOcc 0
11 mol 182 unq 1 iso 0 dist 6.78641 6.72963 6.55146 10.3393 9.19506 13.9827 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.02402 10.5408 8.0943 10.1012 9.09585 6.90619 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 9.28442 16.2737 9.13587 7.05903 7.06636 10.0471 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 9.3032 11.9253 7.56217 9.55026 5.13892 10.3444 numMergedOcc 0
15 mol 194 unq 1 iso 0 dist 9.3032 11.9253 7.56217 5.81844 8.2232 14.1482 numMergedOcc 0
16 mol 194 unq 2 iso 0 dist 8.10451 9.14049 7.56217 7.42146 5.13892 10.3444 numMergedOcc 0
17 mol 194 unq 3 iso 0 dist 8.10451 9.14049 7.56217 14.7061 8.2232 14.1482 numMergedOcc 0
18 mol 194 unq 4 iso 0 dist 6.6747 9.14049 9.81055 7.42146 5.78717 10.3444 numMergedOcc 0
19 mol 194 unq 5 iso 0 dist 6.28412 15.4443 9.81055 10.9095 5.78717 10.3444 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 4.15692 10.2256 9.09279 6.64602 8.38453 11.8314 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 9.12546 11.3284 8.23073 9.25743 6.11157 11.0953 numMergedOcc 0
22 mol 257 unq 1 iso 0 dist 8.71617 10.5994 8.23073 11.7757 6.11157 11.0953 numMergedOcc 0
