0 mol 16 unq 0 iso 0 dist 5.36911 5.72175 6.93532 8.17898 5.30082 5.05803 12.0005 11.7521 6.2983 7.03948 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.36911 5.72175 6.93532 10.6491 10.4366 6.31718 12.0005 11.7521 6.2983 5.47769 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.61491 13.395 6.85556 14.2542 5.68392 6.03987 15.8444 9.71382 10.3635 7.685 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 9.23947 5.59762 9.97159 5.54343 6.21578 9.67592 5.68492 9.32552 5.3948 8.68586 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.66506 12.8388 9.24757 5.79954 5.11416 9.96396 13.1044 7.10439 7.41074 8.70133 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.66506 12.8388 9.24757 10.4766 6.56633 6.19304 13.1044 7.10439 7.41074 4.65521 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.18097 10.5346 9.82915 15.5717 9.29301 7.97049 13.6164 10.0297 7.98917 9.47876 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 9.18097 10.5346 9.82915 17.3382 13.5116 7.47541 13.6164 10.0297 7.98917 7.22293 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 8.83135 18.2314 9.82915 14.5836 9.29301 7.97049 17.2363 10.0297 7.98917 9.47876 numMergedOcc 0
9 mol 85 unq 3 iso 0 dist 8.83135 18.2314 9.82915 20.3056 13.5116 7.47541 17.2363 10.0297 7.98917 7.22293 numMergedOcc 0
10 mol 85 unq 4 iso 0 dist 9.04728 3.85308 7.54568 9.8682 8.09967 6.19965 13.0379 11.8261 11.6116 9.47876 numMergedOcc 0
11 mol 85 unq 5 iso 0 dist 9.04728 3.85308 7.54568 9.22376 4.65335 7.66905 13.0379 11.8261 11.6116 7.22293 numMergedOcc 0
12 mol 85 unq 6 iso 0 dist 9.04728 9.77828 9.39864 9.22376 4.65335 5.73196 13.0379 11.8261 6.47779 7.22293 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 6.15654 5.1767 6.95572 10.9081 9.50382 7.4729 7.31722 5.39745 6.99832 5.81965 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 6.15654 5.1767 6.95572 10.3582 7.56363 6.82344 7.31722 5.39745 6.99832 9.70512 numMergedOcc 0
15 mol 92 unq 2 iso 0 dist 7.89887 5.1767 7.38677 10.9081 12.7565 7.4729 7.31722 10.8154 6.99832 5.81965 numMergedOcc 0
16 mol 92 unq 3 iso 0 dist 7.89887 5.1767 7.38677 10.3582 5.91004 6.82344 7.31722 10.8154 6.99832 9.70512 numMergedOcc 0
17 mol 100 unq 0 iso 0 dist 6.56978 6.23541 7.10378 13.0766 10.6848 7.17106 10.605 11.9163 5.01145 6.58204 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.79832 7.42609 9.77896 6.6776 8.29015 6.57069 10.2578 5.4997 7.5414 9.8589 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 8.82861 9.54287 7.32294 7.7292 5.86489 8.51516 11.695 11.641 12.9483 5.90931 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 7.46122 10.6943 6.59716 8.9077 7.11498 9.23153 10.4277 9.7334 6.7067 6.84247 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 7.46122 10.6943 6.59716 8.9077 7.11498 9.23153 12.6281 13.5801 15.9568 6.99002 numMergedOcc 0
