0 mol 6 unq 0 iso 0 dist 9.94843 9.64829 9.16055 6.30562 5.31617 5.01673 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.45063 6.51139 14.3405 8.19484 11.0096 13.0657 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 8.45063 6.91278 14.4796 8.19484 11.0096 10.5378 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 5.74637 8.87089 6.09578 8.87924 12.8107 12.9041 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.52999 8.99759 7.59764 9.49192 7.19464 10.4656 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.40577 5.82456 9.50189 5.82501 9.20674 4.43177 numMergedOcc 0
6 mol 163 unq 0 iso 0 dist 8.66172 9.24754 13.6047 5.80513 4.2381 10.2408 numMergedOcc 0
7 mol 163 unq 1 iso 0 dist 6.89529 9.24754 8.08989 5.80513 11.7732 10.2408 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.49376 7.80506 10.0449 9.8594 8.71881 7.95114 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 5.33103 5.70065 9.12311 7.31388 5.06201 9.83001 numMergedOcc 0
10 mol 210 unq 1 iso 0 dist 9.01301 5.70065 7.75472 7.31388 6.66834 9.83001 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 8.72285 4.40476 4.79564 8.91912 5.49723 7.13104 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 8.72578 7.81825 13.7573 9.83201 12.8278 4.57003 numMergedOcc 0
13 mol 217 unq 1 iso 0 dist 8.80103 7.81825 3.6199 9.83201 7.58401 4.57003 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 6.22332 6.97662 4.37243 9.65075 6.06047 6.12851 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 9.5942 9.03261 4.1635 6.62391 7.57563 5.70083 numMergedOcc 0
16 mol 226 unq 1 iso 0 dist 9.5942 7.67573 9.6805 6.62391 7.57563 5.19299 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 8.20542 9.51001 13.8826 8.38439 7.05684 15.7632 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 6.28023 7.8547 6.75848 9.91748 5.1571 8.57871 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.47179 9.38187 10.1749 9.60904 9.12324 7.57885 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.47179 9.38187 10.1749 9.60904 9.12324 7.57885 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.47179 9.38187 10.1749 9.60904 9.12324 7.57885 numMergedOcc 0
