0 mol 7 unq 0 iso 0 dist 7.38748 7.15287 6.8464 6.22892 5.0893 8.41585 14.4257 10.1033 7.78327 13.5229 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.85737 6.88453 8.0319 13.0211 11.4109 6.86014 8.11143 4.19221 7.49157 8.66248 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.85737 6.88453 8.0319 13.0211 11.4109 6.86014 10.4823 6.17633 7.73794 6.73521 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.84944 14.9082 8.03754 22.5146 14.0204 8.80331 11.9051 3.83842 9.02471 12.6657 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.84944 14.9082 8.03754 19.6842 13.1056 6.20293 11.9051 3.83842 9.02471 14.0654 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 7.21995 4.80528 8.03754 12.8866 14.0204 8.80331 8.81562 3.83842 9.02471 12.6657 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 7.21995 4.80528 8.03754 10.6604 13.1056 6.20293 8.81562 3.83842 9.02471 14.0654 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.90896 18.2252 9.41049 12.8368 4.60412 5.93252 10.3601 4.40015 9.10566 3.85805 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 9.86325 9.54341 5.68286 13.2707 5.73349 7.9245 14.6801 7.92963 7.69072 3.46486 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.15664 6.09495 7.11695 10.869 14.4144 9.33898 11.2281 4.56304 8.85601 17.4771 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.15664 6.09495 7.11695 14.4679 9.54167 9.64443 11.2281 4.56304 8.85601 10.2467 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 7.6453 4.80675 8.00624 10.1938 15.4586 8.54584 4.4077 6.61102 7.97548 12.5321 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 7.6453 4.80675 8.00624 10.1938 15.4586 8.54584 8.4874 9.0678 9.64164 11.3755 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.65031 14.069 8.41774 21.5408 13.1435 8.56324 18.6599 15.2106 9.00072 12.2243 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 9.65031 14.069 8.41774 19.3797 13.793 6.70283 18.6599 15.2106 9.00072 4.73288 numMergedOcc 0
15 mol 152 unq 2 iso 0 dist 9.65031 14.069 8.41774 15.7694 11.2124 7.16148 18.6599 15.2106 9.00072 4.70284 numMergedOcc 0
16 mol 152 unq 3 iso 0 dist 8.51844 4.46956 8.41774 12.7437 13.1435 8.56324 11.6237 15.2106 9.00072 12.2243 numMergedOcc 0
17 mol 152 unq 4 iso 0 dist 8.51844 4.46956 8.41774 10.5594 13.793 6.70283 11.6237 15.2106 9.00072 4.73288 numMergedOcc 0
18 mol 152 unq 5 iso 0 dist 8.51844 4.46956 8.41774 10.166 11.2124 7.16148 11.6237 15.2106 9.00072 4.70284 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 6.33567 6.51074 7.69358 10.3219 9.80642 6.97229 10.1768 6.09845 7.12221 6.24714 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 6.33567 6.51074 7.69358 10.3219 9.80642 6.97229 10.2662 11.3756 5.4557 4.02333 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.66936 7.44724 4.81916 14.2462 7.94155 9.7748 10.4606 9.21484 4.9764 11.8607 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 6.66936 7.44724 4.81916 14.2462 7.94155 9.7748 13.1741 10.3506 6.36559 10.9137 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 8.15119 5.77904 4.81916 8.35794 7.94155 9.7748 4.1545 9.21484 4.9764 11.8607 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 8.15119 5.77904 4.81916 8.35794 7.94155 9.7748 4.25172 10.3506 6.36559 10.9137 numMergedOcc 0
