0 mol 10 unq 0 iso 0 dist 8.53436 5.66059 5.94028 7.62587 14.6336 9.43029 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 8.99379 9.09041 9.12695 9.32786 14.0838 8.02443 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.73668 8.9536 10.5085 12.3162 17.1053 9.13187 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 9.37708 7.03339 4.6963 8.58795 6.88696 9.26353 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.29439 9.21645 5.8134 5.02595 6.39945 6.18678 numMergedOcc 0
5 mol 181 unq 0 iso 0 dist 4.35909 8.50938 6.70394 11.1674 12.8989 9.06571 numMergedOcc 0
6 mol 181 unq 1 iso 0 dist 4.35909 8.50938 6.70394 10.3533 11.3022 7.35884 numMergedOcc 0
7 mol 181 unq 2 iso 0 dist 5.77393 8.50938 10.8517 11.1674 11.558 9.06571 numMergedOcc 0
8 mol 181 unq 3 iso 0 dist 5.77393 8.50938 10.8517 10.3533 12.4544 7.35884 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 5.13722 6.65725 8.44389 9.35176 12.1896 7.81263 numMergedOcc 0
10 mol 227 unq 0 iso 0 dist 7.99145 6.65275 5.75236 9.92572 11.1592 8.91971 numMergedOcc 0
11 mol 252 unq 0 iso 0 dist 9.42193 9.1191 5.53685 8.846 4.54745 8.09509 numMergedOcc 0
12 mol 279 unq 0 iso 0 dist 8.36655 5.21664 13.4771 5.03816 8.9352 7.17958 numMergedOcc 0
13 mol 279 unq 1 iso 0 dist 8.76889 8.6522 12.7014 7.51644 5.8845 7.17958 numMergedOcc 0
14 mol 279 unq 2 iso 0 dist 7.04397 7.31529 12.7014 3.75346 5.8845 7.17958 numMergedOcc 0
15 mol 279 unq 3 iso 0 dist 6.37469 8.6522 9.63044 7.51644 10.122 7.17958 numMergedOcc 0
