0 mol 73 unq 0 iso 0 dist 7.37476 8.85981 7.52996 6.28936 5.92936 9.28253 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.09587 9.79714 13.0619 12.4461 12.7055 6.83992 numMergedOcc 0
2 mol 90 unq 0 iso 0 dist 8.60438 8.14057 9.18603 11.0399 16.0008 7.49054 numMergedOcc 0
3 mol 94 unq 0 iso 0 dist 8.93438 8.13248 6.0901 9.27318 14.5401 9.33801 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.26301 7.91231 7.65733 12.5962 5.31281 7.25166 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 5.2929 6.3982 5.3967 5.93926 7.67341 6.7225 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 6.17589 6.3982 7.10772 5.93926 11.1256 6.7225 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 9.83241 9.54663 4.80675 8.10347 7.07421 6.29026 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 7.67974 7.21035 4.85077 6.16006 8.94671 7.86625 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.66105 6.9028 8.22716 10.0531 8.5434 8.48112 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 9.64006 6.9028 9.18635 10.0531 17.1649 8.48112 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 7.73969 6.67907 5.52669 10.4934 9.13126 9.10613 numMergedOcc 0
12 mol 257 unq 0 iso 0 dist 9.91996 5.16581 5.54149 3.72932 12.7395 8.69184 numMergedOcc 0
13 mol 257 unq 1 iso 0 dist 9.91996 5.13633 10.8918 3.72932 12.7395 8.18901 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.27225 8.14812 4.6881 4.49451 8.97411 5.73296 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 9.60879 6.86014 7.44724 9.93994 6.23539 6.90434 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.92271 6.86014 5.77904 9.93994 12.4458 6.90434 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 8.62666 5.97073 5.77904 9.83255 12.4458 6.90434 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 4.86518 8.62414 4.7203 18.1946 14.4424 9.82774 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 8.92737 8.86937 11.8346 8.7019 16.9189 9.37818 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 7.15278 8.98536 11.8346 10.8231 16.9189 9.37818 numMergedOcc 0
