0 mol 7 unq 0 iso 0 dist 4.47024 5.3595 9.33703 6.26213 9.5325 5.05728 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 6.78356 5.81148 9.01516 4.85596 9.78177 9.10389 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 6.78356 5.81148 9.01516 12.282 7.03635 15.9259 numMergedOcc 0
3 mol 56 unq 2 iso 0 dist 6.78356 8.85692 7.31255 4.85596 9.78177 9.82154 numMergedOcc 0
4 mol 56 unq 3 iso 0 dist 6.78356 8.85692 7.31255 12.282 7.03635 5.83999 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 7.77954 8.1892 9.47519 5.4212 7.66318 6.4516 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 6.0478 6.22963 9.47519 4.94708 7.66318 6.4516 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.91206 14.1204 8.0534 10.7405 8.39494 9.90214 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.67513 15.8898 8.0534 11.5055 8.39494 9.90214 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 7.73842 7.22809 6.07991 5.50163 5.5606 8.76178 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 4.83761 11.8195 9.8727 6.05119 7.28496 8.38434 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.74308 15.1003 9.40296 17.1735 9.86161 7.25241 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.74308 15.1003 9.40296 10.6036 6.13396 5.17199 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 5.47295 9.1439 7.30969 6.77956 8.19109 13.0184 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 9.04499 15.0661 7.11989 4.98993 5.98014 10.4947 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.84798 16.3239 7.84195 17.447 9.56438 4.8694 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 8.84798 12.5605 9.2174 17.447 9.56438 14.5542 numMergedOcc 0
