0 mol 5 unq 0 iso 0 dist 6.84403 12.3662 9.45559 4.67908 5.63302 8.27541 numMergedOcc 0
1 mol 114 unq 0 iso 0 dist 8.18356 6.20949 7.4113 9.2706 5.45716 5.27337 numMergedOcc 0
2 mol 114 unq 1 iso 0 dist 8.18356 15.013 8.53631 9.2706 5.45716 10.7729 numMergedOcc 0
3 mol 152 unq 0 iso 0 dist 9.3776 6.27142 9.07315 3.68475 9.981 6.30341 numMergedOcc 0
4 mol 152 unq 1 iso 0 dist 9.3776 6.27142 9.07315 12.8325 7.78215 13.95 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 8.88037 11.2395 8.06817 5.81715 7.33178 13.5453 numMergedOcc 0
6 mol 182 unq 0 iso 0 dist 8.10542 7.44165 6.55146 4.43652 7.30461 3.7332 numMergedOcc 0
7 mol 182 unq 1 iso 0 dist 6.78641 6.72963 6.55146 8.87616 7.30461 3.7332 numMergedOcc 0
8 mol 185 unq 0 iso 0 dist 9.62449 4.97475 9.61525 11.343 8.22259 7.4828 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.19926 8.15466 4.79423 15.9745 9.64977 7.88814 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 6.6747 9.14049 9.81055 4.83816 8.93352 11.6792 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 6.28412 15.4443 9.81055 14.1072 8.93352 11.6792 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 9.54448 4.7722 5.73198 8.2828 7.51798 4.91317 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 4.15692 10.2256 9.09279 8.43342 8.63893 7.39922 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 7.36685 13.3047 7.36137 11.735 8.53393 5.62596 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 7.36685 5.66268 6.83784 11.735 8.53393 9.61883 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 9.20906 9.22203 4.95415 11.7937 7.24165 5.62596 numMergedOcc 0
17 mol 266 unq 3 iso 0 dist 9.20906 9.32644 6.38519 11.7937 7.24165 9.61883 numMergedOcc 0
18 mol 266 unq 4 iso 0 dist 9.03099 13.3047 4.95415 11.735 7.24165 5.62596 numMergedOcc 0
19 mol 266 unq 5 iso 0 dist 9.03099 5.66268 6.38519 11.735 7.24165 9.61883 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 5.06373 10.1082 8.2236 7.63537 8.82497 16.0873 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 8.88717 5.29647 6.07843 3.62492 7.8605 6.63786 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 9.84651 6.56958 6.07843 3.93543 7.8605 6.63786 numMergedOcc 0
