0 mol 12 unq 0 iso 0 dist 9.75368 9.52857 10.9547 11.7488 18.7553 9.90835 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.60595 8.37378 10.1154 4.64441 8.85174 6.23015 numMergedOcc 0
2 mol 60 unq 0 iso 0 dist 7.7654 6.65867 5.32257 4.70443 7.48086 6.63448 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.0139 9.76351 9.69296 14.463 14.6142 9.77084 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 8.0139 9.76351 9.69296 13.9245 11.2699 6.5551 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 8.67414 6.09256 9.96719 6.79366 7.94633 7.77089 numMergedOcc 0
6 mol 105 unq 1 iso 0 dist 9.94398 8.40598 11.0132 4.59356 9.16718 7.77089 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 8.00624 9.7113 4.92472 6.31483 5.51197 6.34626 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 8.42289 9.7113 12.263 6.31483 12.8996 6.34626 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 6.36439 8.60004 7.51976 7.59527 8.33439 8.71789 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 9.84466 9.0515 9.09988 11.793 16.8309 8.48879 numMergedOcc 0
11 mol 196 unq 1 iso 0 dist 9.84466 9.0515 9.09988 10.1127 13.6262 5.89591 numMergedOcc 0
12 mol 196 unq 2 iso 0 dist 9.84466 9.0515 9.09988 13.3826 14.0663 9.72376 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 9.19061 9.60514 11.1439 5.14649 13.2461 8.63279 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.44947 7.59757 5.86489 14.13 7.9133 9.48625 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 5.90804 5.91739 9.52712 4.58625 10.0129 6.15635 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 9.37841 9.65597 4.60101 11.7146 12.205 7.85836 numMergedOcc 0
17 mol 273 unq 1 iso 0 dist 9.37841 9.65597 4.60101 7.90253 9.59325 6.35532 numMergedOcc 0
18 mol 275 unq 0 iso 0 dist 8.33337 7.01071 4.33371 4.02257 11.0346 9.91011 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 4.81916 9.35976 7.70529 13.1828 8.9682 9.26157 numMergedOcc 0
