0 mol 43 unq 0 iso 0 dist 9.16827 12.092 6.20293 19.6692 13.1056 8.03754 14.9909 8.13395 8.80331 14.0204 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 7.67586 11.7065 7.71095 19.9041 13.0222 9.83775 18.2379 12.5396 8.84665 5.82428 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 7.67586 11.7065 7.71095 19.9041 13.0222 9.83775 13.1891 8.19458 8.25513 10.1226 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 8.97292 14.1347 7.71095 18.8841 13.0222 9.83775 20.4157 12.5396 8.84665 5.82428 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 8.97292 14.1347 7.71095 18.8841 13.0222 9.83775 17.0558 8.19458 8.25513 10.1226 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.99643 8.2572 6.72123 7.45482 4.78811 8.44473 13.6976 6.86346 6.65721 11.2947 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 8.22406 5.41023 9.64443 7.75977 9.54167 7.11695 13.6801 13.1316 9.33898 14.4144 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 6.05043 6.40193 7.27724 12.6033 12.0894 9.64673 10.3984 8.41707 8.03644 16.4832 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 5.09688 12.2879 7.47343 17.7333 12.9061 9.22737 13.6601 8.8807 6.65086 6.60925 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 5.09688 12.2879 7.47343 17.7333 12.9061 9.22737 17.6466 12.6515 6.56369 4.95357 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 5.09688 12.2879 7.47343 17.7333 12.9061 9.22737 18.8484 13.887 9.30209 5.05858 numMergedOcc 0
11 mol 100 unq 3 iso 0 dist 9.26343 16.4386 7.47343 21.0462 12.9061 9.22737 16.1978 8.8807 6.65086 6.60925 numMergedOcc 0
12 mol 100 unq 4 iso 0 dist 9.26343 16.4386 7.47343 21.0462 12.9061 9.22737 21.6939 12.6515 6.56369 4.95357 numMergedOcc 0
13 mol 100 unq 5 iso 0 dist 9.26343 16.4386 7.47343 21.0462 12.9061 9.22737 21.5791 13.887 9.30209 5.05858 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 6.01118 9.73148 6.69288 17.498 14.4816 9.63185 10.064 5.34677 6.43573 10.2893 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 6.01118 9.73148 6.69288 17.498 14.4816 9.63185 16.3874 11.7381 7.17202 9.7684 numMergedOcc 0
16 mol 178 unq 2 iso 0 dist 6.01118 9.73148 6.69288 17.498 14.4816 9.63185 18.2053 14.0703 8.81551 5.37264 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 8.93637 14.8074 9.23153 16.1793 13.3213 5.39218 15.9523 10.5449 8.24498 11.4842 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.22378 6.8193 6.60405 14.3889 8.81588 9.04358 10.6039 7.26417 6.42289 5.90131 numMergedOcc 0
19 mol 261 unq 0 iso 0 dist 7.26647 9.29412 8.43057 9.83819 5.09097 5.00128 10.6622 10.0727 8.02547 9.40373 numMergedOcc 0
20 mol 261 unq 1 iso 0 dist 7.26647 9.29412 8.43057 9.83819 5.09097 5.00128 7.7309 4.63549 6.05727 4.86901 numMergedOcc 0
21 mol 261 unq 2 iso 0 dist 7.26647 9.29412 8.43057 15.4115 11.9784 6.58604 10.6622 10.0727 8.02547 10.3517 numMergedOcc 0
22 mol 261 unq 3 iso 0 dist 7.26647 9.29412 8.43057 15.4115 11.9784 6.58604 7.7309 4.63549 6.05727 9.47323 numMergedOcc 0
23 mol 261 unq 4 iso 0 dist 7.26647 9.29412 8.43057 14.5563 11.6843 7.30472 10.6622 10.0727 8.02547 6.43209 numMergedOcc 0
24 mol 261 unq 5 iso 0 dist 7.26647 9.29412 8.43057 14.5563 11.6843 7.30472 7.7309 4.63549 6.05727 7.78464 numMergedOcc 0
25 mol 261 unq 6 iso 0 dist 7.7309 9.29412 6.05727 9.83819 4.86901 5.00128 10.6622 5.51688 8.02547 9.40373 numMergedOcc 0
26 mol 261 unq 7 iso 0 dist 7.7309 9.29412 6.05727 9.83819 4.86901 5.00128 7.26647 4.63549 8.43057 5.09097 numMergedOcc 0
27 mol 261 unq 8 iso 0 dist 7.7309 9.29412 6.05727 15.4115 9.47323 6.58604 10.6622 5.51688 8.02547 10.3517 numMergedOcc 0
28 mol 261 unq 9 iso 0 dist 7.7309 9.29412 6.05727 15.4115 9.47323 6.58604 7.26647 4.63549 8.43057 11.9784 numMergedOcc 0
29 mol 261 unq 10 iso 0 dist 7.7309 9.29412 6.05727 14.5563 7.78464 7.30472 10.6622 5.51688 8.02547 6.43209 numMergedOcc 0
30 mol 261 unq 11 iso 0 dist 7.7309 9.29412 6.05727 14.5563 7.78464 7.30472 7.26647 4.63549 8.43057 11.6843 numMergedOcc 0
31 mol 282 unq 0 iso 0 dist 7.70229 8.93697 8.76532 14.4176 11.2986 7.71088 10.9708 10.0156 8.04483 5.86383 numMergedOcc 0
32 mol 282 unq 1 iso 0 dist 7.70229 8.93697 8.76532 14.4176 11.2986 7.71088 7.90792 4.66602 6.33524 7.46064 numMergedOcc 0
33 mol 282 unq 2 iso 0 dist 7.90792 8.93697 6.33524 14.4176 7.46064 7.71088 10.9708 5.39891 8.04483 5.86383 numMergedOcc 0
34 mol 282 unq 3 iso 0 dist 7.90792 8.93697 6.33524 14.4176 7.46064 7.71088 7.70229 4.66602 8.76532 11.2986 numMergedOcc 0
