0 mol 48 unq 0 iso 0 dist 9.65989 5.36645 10.2391 7.51675 16.5247 9.17838 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 8.66272 5.36645 10.8186 7.51675 15.9447 9.17838 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.85982 5.57389 5.31976 8.95801 9.90923 7.39665 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 9.36674 7.44784 6.06198 6.3642 8.86846 6.04595 numMergedOcc 0
4 mol 132 unq 0 iso 0 dist 7.73306 6.495 11.6877 7.05332 8.62632 6.89918 numMergedOcc 0
5 mol 132 unq 1 iso 0 dist 7.73306 9.43748 11.8999 7.05332 8.62632 7.89457 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.84695 5.67862 8.44345 7.77359 14.581 9.33924 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.84695 5.67862 8.44345 10.8891 16.2038 7.93372 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.78154 5.30872 7.64386 5.88056 9.5233 5.37047 numMergedOcc 0
9 mol 143 unq 1 iso 0 dist 5.9183 5.30872 5.11989 5.88056 9.33882 5.37047 numMergedOcc 0
10 mol 143 unq 2 iso 0 dist 5.9183 7.5984 6.3915 14.6282 12.82 7.36975 numMergedOcc 0
11 mol 143 unq 3 iso 0 dist 5.9183 7.5984 6.3915 7.11802 9.84746 5.40637 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 8.22267 9.36307 4.85077 5.62883 8.8774 9.56028 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.29651 7.45401 12.5982 5.85073 11.305 6.61112 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 5.65146 6.99623 5.47219 13.4486 8.25953 9.3498 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 9.94746 9.90668 6.92624 14.2983 9.89519 9.62437 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 9.48678 8.09769 13.0834 4.74338 12.6227 4.33238 numMergedOcc 0
17 mol 219 unq 1 iso 0 dist 9.48678 7.24832 6.90908 4.74338 12.6227 7.83604 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 9.03969 9.94212 10.6103 8.1388 7.27963 6.42257 numMergedOcc 0
19 mol 223 unq 1 iso 0 dist 9.03969 9.94212 10.6103 14.288 18.9404 9.33543 numMergedOcc 0
20 mol 229 unq 0 iso 0 dist 5.22312 8.0007 6.44004 6.80826 9.10498 6.95201 numMergedOcc 0
21 mol 280 unq 0 iso 0 dist 6.88553 9.26066 6.07005 8.13853 7.4869 6.02353 numMergedOcc 0
