0 mol 24 unq 0 iso 0 dist 8.20058 12.1567 6.72502 13.0079 11.2106 9.40479 11.6434 5.11636 8.24948 9.57743 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.20058 12.1567 6.72502 13.7923 5.97304 9.38831 11.6434 5.11636 8.24948 4.47891 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.17086 8.33667 9.93832 12.0359 7.05402 7.31982 13.0289 10.8828 7.24352 4.69849 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.77018 7.79856 8.63486 12.1145 12.8132 6.91393 5.91948 6.15355 5.07125 8.12964 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 9.77018 7.79856 8.63486 12.9309 16.7219 8.40038 5.91948 6.15355 5.07125 11.6453 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.88255 6.89245 7.77116 10.4602 4.91132 8.03035 6.88175 6.9194 9.6121 6.71103 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.88255 6.89245 7.77116 10.4602 4.91132 8.03035 14.8889 9.68677 9.57341 6.29394 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 8.88255 6.89245 7.77116 11.794 6.08167 7.6968 6.88175 6.9194 9.6121 12.4868 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.88255 6.89245 7.77116 11.794 6.08167 7.6968 14.8889 9.68677 9.57341 9.64502 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 8.99949 14.8405 9.29384 22.1491 15.7796 7.76594 19.8448 12.6005 6.78801 4.24991 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 7.83582 11.3235 5.39064 16.4229 8.83949 6.98813 12.2398 4.91618 7.19291 7.10913 numMergedOcc 0
11 mol 140 unq 1 iso 0 dist 7.83582 11.3235 5.39064 16.4229 8.83949 6.98813 11.2557 4.75859 6.66504 6.30391 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 7.34465 7.97183 6.69515 14.8886 9.76015 8.26172 13.7901 13.2918 6.77921 10.2834 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 9.47675 7.97183 7.86572 14.8886 8.24418 8.26172 13.7901 13.4066 6.77921 10.2834 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 7.13441 6.15895 5.10618 13.5884 9.61561 7.82546 13.2972 13.9189 9.13027 8.8243 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 9.60159 11.2986 8.38865 13.5057 10.5813 9.56257 10.4038 4.1511 5.28771 11.2819 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.38753 8.09178 5.52379 9.28463 14.1055 9.89583 11.0533 4.48415 6.53286 13.0611 numMergedOcc 0
17 mol 251 unq 0 iso 0 dist 7.54763 8.51564 8.01198 13.1045 6.6269 8.53757 7.95984 4.86046 6.42747 8.08775 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 6.8902 5.86656 6.14323 11.5801 9.37297 5.74568 11.1879 13.2035 7.14086 7.36132 numMergedOcc 0
