0 mol 2 unq 0 iso 0 dist 9.08872 5.30739 9.9859 12.2379 9.39313 16.202 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 7.37296 15.0954 9.9859 4.80061 9.39313 16.202 numMergedOcc 0
2 mol 4 unq 0 iso 0 dist 4.88114 8.98718 9.06123 6.50919 8.35272 3.8832 numMergedOcc 0
3 mol 4 unq 1 iso 0 dist 4.88114 5.52224 9.22272 6.50919 8.35272 3.91197 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 8.23606 9.24792 7.42925 7.00034 7.49423 11.1199 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 6.04551 11.3175 7.78475 15.0431 9.54119 7.17582 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 6.04551 11.3175 7.78475 4.92775 7.87476 10.6665 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 8.28883 8.91456 9.46554 5.29743 7.37491 3.85506 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 6.01454 10.7098 6.99001 15.1442 9.77004 7.06935 numMergedOcc 0
9 mol 48 unq 4 iso 0 dist 6.01454 10.7098 6.99001 4.89976 8.36323 10.6648 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 7.53834 5.56412 5.11444 11.2878 8.78397 5.83776 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 6.21267 6.19534 5.5781 10.0862 8.58178 4.82566 numMergedOcc 0
12 mol 183 unq 1 iso 0 dist 6.21267 6.19534 5.5781 8.68367 4.77438 3.74873 numMergedOcc 0
13 mol 183 unq 2 iso 0 dist 6.21267 6.19534 5.5781 8.36315 5.73344 5.77609 numMergedOcc 0
14 mol 183 unq 3 iso 0 dist 7.41743 5.59412 5.5781 10.0647 8.58178 4.82566 numMergedOcc 0
15 mol 183 unq 4 iso 0 dist 7.41743 5.59412 5.5781 7.5521 4.77438 3.74873 numMergedOcc 0
16 mol 183 unq 5 iso 0 dist 7.41743 5.59412 5.5781 3.17225 5.73344 5.77609 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 9.45847 8.78943 5.0207 4.75805 8.98606 6.04545 numMergedOcc 0
18 mol 250 unq 0 iso 0 dist 8.18086 8.5106 5.99119 8.32095 8.54286 4.14699 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 8.13696 6.83989 9.56846 6.61744 8.43724 9.71158 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 6.23539 5.41599 5.92532 13.6904 9.48076 12.1127 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.84011 5.18949 6.72935 8.19595 9.14721 8.59329 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 9.84011 5.18949 6.72935 7.37483 7.15322 6.1459 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 8.04003 7.04567 8.9316 4.57745 9.78064 3.96271 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 8.04003 7.04567 8.9316 4.57745 9.78064 3.96271 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 8.04003 7.04567 8.9316 4.57745 9.78064 3.96271 numMergedOcc 0
