0 mol 12 unq 0 iso 0 dist 8.8993 5.44478 8.27891 7.00079 13.5592 8.18296 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 8.8993 5.44478 8.27891 6.50215 14.8056 7.99569 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 8.51194 4.70371 10.3609 9.10397 17.0799 9.89804 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 7.55718 6.57749 6.26086 7.92725 12.8341 7.41937 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 7.55718 6.57749 6.26086 7.26324 10.7205 6.07108 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 8.94847 5.5851 6.04753 5.03448 12.4555 9.46568 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.61215 9.01131 11.4714 6.03683 7.36361 9.52442 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 9.06392 4.81596 11.9038 6.24872 10.4714 7.00113 numMergedOcc 0
8 mol 125 unq 1 iso 0 dist 9.06392 4.81596 11.9038 10.4668 13.2906 9.85979 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.72322 8.66056 10.0941 11.4363 14.0246 8.07946 numMergedOcc 0
10 mol 174 unq 0 iso 0 dist 7.97746 5.11555 5.94137 6.09052 12.978 9.31454 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 8.54623 5.99974 10.6534 5.27811 8.6938 7.37823 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.46045 7.19924 8.46479 5.93253 9.499 9.85821 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 6.4889 9.31855 5.3246 7.27483 9.41595 7.60896 numMergedOcc 0
14 mol 284 unq 0 iso 0 dist 7.41633 5.62295 12.6047 8.51351 13.6175 4.87349 numMergedOcc 0
15 mol 284 unq 1 iso 0 dist 5.52837 5.62295 10.936 8.51351 13.2942 4.87349 numMergedOcc 0
16 mol 284 unq 2 iso 0 dist 6.73163 5.62295 10.1049 8.51351 13.0983 4.87349 numMergedOcc 0
