0 mol 30 unq 0 iso 0 dist 9.51276 6.43282 9.46088 7.6593 8.25499 4.60956 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.03899 6.30843 8.60575 4.83564 6.11574 5.01912 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.39344 5.37184 9.48287 8.19733 7.64192 5.98346 numMergedOcc 0
3 mol 105 unq 0 iso 0 dist 6.37212 5.56565 5.30577 11.0792 9.96269 10.6016 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 7.85994 4.95967 6.5332 10.8513 9.00302 6.0128 numMergedOcc 0
5 mol 172 unq 0 iso 0 dist 6.16303 11.6276 9.91479 6.78233 7.77643 13.0825 numMergedOcc 0
6 mol 172 unq 1 iso 0 dist 6.16303 11.6276 9.91479 8.65462 4.90175 12.1824 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 7.74764 15.5685 8.39237 5.80424 9.60838 15.2663 numMergedOcc 0
8 mol 209 unq 0 iso 0 dist 8.9906 12.0494 8.31544 13.8836 8.8886 5.96238 numMergedOcc 0
9 mol 209 unq 1 iso 0 dist 8.9906 12.0494 8.31544 15.5731 8.78565 5.04469 numMergedOcc 0
10 mol 241 unq 0 iso 0 dist 9.89398 9.50652 8.92649 4.51587 8.00841 5.14928 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 8.88803 4.12383 8.67835 5.14726 8.13605 6.0591 numMergedOcc 0
12 mol 277 unq 0 iso 0 dist 4.66834 7.48053 5.37738 5.57184 6.40125 10.6569 numMergedOcc 0
13 mol 277 unq 1 iso 0 dist 4.66834 7.48053 5.37738 10.4217 7.25282 4.09948 numMergedOcc 0
