0 mol 24 unq 0 iso 0 dist 8.23075 4.7841 6.0925 7.6222 7.18124 6.47026 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.23075 4.7841 6.0925 14.8593 8.10168 13.8832 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 4.7841 8.23075 6.0925 7.6222 6.47026 7.18124 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.83836 9.58351 8.81968 6.14227 9.60811 13.4192 numMergedOcc 0
4 mol 111 unq 0 iso 0 dist 5.98809 9.06601 8.72808 6.3561 7.24101 13.9368 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 7.53694 8.38358 5.26524 10.885 9.8098 14.0063 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 6.42623 8.95899 8.68088 4.98499 9.43682 8.0564 numMergedOcc 0
7 mol 120 unq 2 iso 0 dist 8.95899 6.42623 8.68088 4.98499 8.0564 9.43682 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 6.73617 9.03544 3.6066 9.58148 9.28718 9.68833 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 7.59457 6.79114 6.01609 14.4437 9.981 11.7116 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 7.59457 6.79114 6.01609 8.18329 7.78215 12.0971 numMergedOcc 0
11 mol 231 unq 0 iso 0 dist 7.3268 9.9868 13.1222 6.58152 5.45266 14.2243 numMergedOcc 0
12 mol 231 unq 1 iso 0 dist 7.3268 9.9868 13.1222 9.72658 9.02803 12.3008 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 8.94786 9.1927 6.8233 7.05009 9.01486 13.3945 numMergedOcc 0
14 mol 253 unq 1 iso 0 dist 8.94786 9.60694 15.2509 7.05009 9.01486 16.2782 numMergedOcc 0
15 mol 253 unq 2 iso 0 dist 8.94786 9.27311 17.0369 7.05009 9.01486 15.9083 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 5.4557 7.12221 8.40845 9.31785 7.59138 14.1997 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 8.12739 6.09853 5.57024 12.292 8.87546 13.5735 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 6.71946 8.28061 9.00617 6.40962 7.8605 14.0418 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 6.71946 5.03601 7.33055 6.40962 7.8605 10.4548 numMergedOcc 0
