0 mol 13 unq 0 iso 0 dist 6.02651 9.65051 10.4833 11.1689 13.0931 5.99004 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.67141 6.67079 4.57655 5.43691 10.757 6.67704 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 7.12853 8.72533 6.64442 3.843 6.14513 9.14345 numMergedOcc 0
3 mol 71 unq 1 iso 0 dist 6.14513 9.14345 6.64442 3.843 7.12853 8.72533 numMergedOcc 0
4 mol 71 unq 2 iso 0 dist 7.4392 9.14345 11.496 3.843 9.1134 8.72533 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.225 4.73362 4.98309 8.15383 9.52666 7.3795 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 5.37449 7.3795 7.75939 8.15383 11.0609 4.73362 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 9.52666 7.3795 4.98309 8.15383 9.225 4.73362 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 9.06717 9.92798 8.5743 6.42012 11.2264 8.53023 numMergedOcc 0
9 mol 96 unq 1 iso 0 dist 7.96523 8.53023 4.0331 6.42012 9.579 9.92798 numMergedOcc 0
10 mol 96 unq 2 iso 0 dist 9.579 9.92798 4.0331 6.42012 7.96523 8.53023 numMergedOcc 0
11 mol 96 unq 3 iso 0 dist 8.71026 9.87414 12.8509 5.82135 12.4392 8.9536 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 7.88143 6.04768 12.9271 5.4823 10.5625 9.40173 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 6.62952 6.04768 12.2431 5.4823 4.3521 9.40173 numMergedOcc 0
14 mol 98 unq 2 iso 0 dist 4.3521 9.40173 12.2431 5.4823 6.62952 6.04768 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 5.50879 8.32841 5.6621 11.1396 6.69157 6.56065 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 6.69157 6.56065 5.6621 11.1396 5.50879 8.32841 numMergedOcc 0
17 mol 226 unq 0 iso 0 dist 8.24741 6.82883 4.66376 8.0668 5.07958 8.22518 numMergedOcc 0
18 mol 226 unq 1 iso 0 dist 8.24741 6.82883 4.66376 12.401 6.19519 6.02803 numMergedOcc 0
19 mol 226 unq 2 iso 0 dist 8.24741 6.95495 13.3747 6.70225 13.8221 7.57964 numMergedOcc 0
20 mol 226 unq 3 iso 0 dist 5.07958 8.22518 4.66376 8.0668 8.24741 6.82883 numMergedOcc 0
21 mol 226 unq 4 iso 0 dist 5.07958 8.22518 4.66376 9.9701 6.19519 6.02803 numMergedOcc 0
22 mol 226 unq 5 iso 0 dist 6.19519 6.02803 4.66376 12.401 8.24741 6.82883 numMergedOcc 0
23 mol 226 unq 6 iso 0 dist 6.19519 6.02803 4.66376 9.9701 5.07958 8.22518 numMergedOcc 0
24 mol 241 unq 0 iso 0 dist 8.00841 9.14228 9.30696 14.1116 12.3964 9.04127 numMergedOcc 0
25 mol 241 unq 1 iso 0 dist 7.91178 9.04127 9.39021 14.1116 15.5011 9.14228 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 6.2667 5.60146 4.89551 11.0309 10.9581 9.80249 numMergedOcc 0
