0 mol 63 unq 0 iso 0 dist 6.57773 8.1123 9.57875 8.74231 7.43519 15.2214 numMergedOcc 0
1 mol 114 unq 0 iso 0 dist 9.26301 5.09285 7.22809 7.91231 7.65733 4.24853 numMergedOcc 0
2 mol 115 unq 0 iso 0 dist 5.2929 8.98702 9.50302 6.61066 6.07331 12.4408 numMergedOcc 0
3 mol 115 unq 1 iso 0 dist 5.2929 8.98702 9.50302 6.3982 5.3967 5.47689 numMergedOcc 0
4 mol 115 unq 2 iso 0 dist 6.17589 8.98702 6.0336 6.61066 7.09627 12.4408 numMergedOcc 0
5 mol 115 unq 3 iso 0 dist 6.17589 8.98702 6.0336 6.3982 7.10772 5.47689 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 4.85278 8.82137 11.9303 9.72828 8.40346 9.29369 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 7.17789 6.03801 9.36417 5.47189 12.5982 8.61343 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 8.86673 9.08415 9.36078 7.69466 10.0248 5.93294 numMergedOcc 0
9 mol 228 unq 0 iso 0 dist 8.53297 9.82472 11.0444 9.46214 7.05573 6.25423 numMergedOcc 0
10 mol 228 unq 1 iso 0 dist 9.23333 9.94292 6.25558 8.81885 7.8494 8.77278 numMergedOcc 0
11 mol 228 unq 2 iso 0 dist 9.23333 9.53671 13.9405 8.81885 7.8494 6.97488 numMergedOcc 0
12 mol 228 unq 3 iso 0 dist 6.02491 9.79674 6.25558 9.51602 5.84747 6.03966 numMergedOcc 0
13 mol 228 unq 4 iso 0 dist 9.21065 9.87391 14.1268 8.89311 8.07826 6.85879 numMergedOcc 0
14 mol 228 unq 5 iso 0 dist 9.21065 9.72673 6.31197 8.89311 8.07826 8.80311 numMergedOcc 0
15 mol 228 unq 6 iso 0 dist 5.89577 9.82472 6.31197 9.46214 5.70777 6.25423 numMergedOcc 0
16 mol 228 unq 7 iso 0 dist 8.6694 9.79674 10.9081 9.51602 7.18261 6.03966 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 8.41604 9.23318 11.6792 9.39439 7.92104 6.30265 numMergedOcc 0
18 mol 233 unq 1 iso 0 dist 9.06221 7.67027 10.3691 4.94074 10.2837 9.8029 numMergedOcc 0
19 mol 271 unq 0 iso 0 dist 7.90629 7.88092 7.94329 7.59727 7.30308 5.31774 numMergedOcc 0
20 mol 275 unq 0 iso 0 dist 8.55256 9.80175 7.36174 9.94511 9.41448 8.14605 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 7.15278 9.83069 9.503 5.71661 6.99988 13.8637 numMergedOcc 0
22 mol 294 unq 1 iso 0 dist 7.15278 9.83069 9.503 8.98536 11.8346 18.0966 numMergedOcc 0
