0 mol 10 unq 0 iso 0 dist 9.1125 14.7966 9.03951 19.1898 11.8048 9.39017 numMergedOcc 0
1 mol 75 unq 0 iso 0 dist 6.88616 6.71593 9.10622 5.47459 6.64067 9.04661 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 5.74637 8.09473 7.01545 8.87089 6.09578 8.20319 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 6.36357 11.6508 9.68619 12.8066 7.12864 9.50699 numMergedOcc 0
4 mol 103 unq 1 iso 0 dist 5.52999 9.46459 9.68619 10.8993 7.12864 9.50699 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.40577 3.88006 4.86767 5.82456 9.50189 8.55826 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.67429 5.57288 7.92221 11.9107 6.80479 8.3971 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 7.67429 5.57288 7.92221 9.62357 6.42183 6.74026 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 9.7589 11.2067 9.18949 14.2468 6.05119 8.24653 numMergedOcc 0
9 mol 146 unq 0 iso 0 dist 9.48667 6.27901 8.68292 6.14952 4.92417 6.47434 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 9.8446 9.96973 5.79029 9.63241 5.54803 9.41943 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 6.20851 4.47323 6.4751 10.1182 6.01258 8.29782 numMergedOcc 0
12 mol 171 unq 1 iso 0 dist 6.20851 4.73373 5.75085 11.9664 8.73818 7.61144 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 8.84813 15.7288 9.31172 19.7697 11.5983 8.14167 numMergedOcc 0
14 mol 174 unq 0 iso 0 dist 4.77805 4.01137 5.07761 10.3665 9.22406 7.54918 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 4.45738 11.5701 8.82861 18.7026 15.6012 7.59757 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 8.40674 10.7268 6.29945 11.1563 7.01958 8.54404 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 9.80493 6.15348 5.75889 10.0868 5.20921 6.85471 numMergedOcc 0
18 mol 271 unq 1 iso 0 dist 6.75395 6.15348 7.03848 10.0868 6.59541 6.85471 numMergedOcc 0
