0 mol 21 unq 0 iso 0 dist 9.24767 4.2995 7.05407 8.90496 3.76294 5.63735 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.23015 8.97282 8.07318 12.0615 3.904 9.16515 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.3224 10.0107 7.27243 16.6826 9.01474 9.4577 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 6.17708 4.16606 5.27182 8.4436 3.91611 6.13351 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 6.72469 3.62638 5.7369 6.27321 7.71726 7.98985 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.28726 10.8273 9.59729 16.166 10.1364 7.46095 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 6.99586 10.4961 9.99441 9.96547 11.7168 6.59716 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 6.14652 11.6261 8.62504 6.08299 6.93712 9.0176 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 7.96353 6.67639 8.14226 11.4172 15.3699 7.83568 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.05627 6.83215 7.92216 6.10556 3.98068 5.92302 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.05627 6.83215 7.92216 10.6489 10.1551 5.29898 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.71155 7.06734 7.01095 13.4902 4.8427 8.33407 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 8.09403 8.04827 4.61596 6.71675 4.67256 7.81263 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.00537 12.9635 8.5672 6.19189 4.03697 9.99396 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 8.9388 4.68208 8.5672 8.34668 4.03697 9.99396 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 8.95209 12.4508 5.86483 10.4896 5.65634 6.56416 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.36144 11.622 9.09594 13.2258 5.70985 8.24419 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 6.28826 10.996 8.25329 9.10678 3.94038 5.31416 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 6.28826 5.055 4.85332 9.10678 3.94038 5.44533 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 5.9625 4.51728 8.93212 5.27184 3.86189 6.15635 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 9.22453 10.3171 7.16209 6.71956 6.64795 9.26157 numMergedOcc 0
