0 mol 17 unq 0 iso 0 dist 9.84064 8.84341 16.4709 7.77965 13.8457 7.02884 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 7.96836 7.02884 13.5569 7.77965 14.3933 8.84341 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 7.66522 8.84341 13.9821 7.77965 8.49309 7.02884 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 8.49309 7.02884 13.9821 7.77965 7.66522 8.84341 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.85245 9.53735 5.60332 15.2626 8.43571 9.34599 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.43571 9.34599 5.60332 15.2626 6.85245 9.53735 numMergedOcc 0
6 mol 28 unq 0 iso 0 dist 7.84931 6.68029 7.09981 9.01928 6.64392 6.44166 numMergedOcc 0
7 mol 28 unq 1 iso 0 dist 6.64392 6.44166 7.09981 9.01928 7.84931 6.68029 numMergedOcc 0
8 mol 53 unq 0 iso 0 dist 6.86092 5.66861 6.52918 6.00278 11.1454 5.80996 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 8.90164 8.14607 6.29197 8.27485 12.4388 7.38868 numMergedOcc 0
10 mol 83 unq 0 iso 0 dist 8.9024 6.07433 11.4438 3.44475 12.32 7.01146 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 7.3864 7.55095 4.87437 5.88837 11.0887 9.13301 numMergedOcc 0
12 mol 124 unq 1 iso 0 dist 7.18643 9.13301 12.5465 5.88837 12.6324 7.55095 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 7.75233 9.58371 11.5292 7.26245 13.344 7.13199 numMergedOcc 0
14 mol 203 unq 0 iso 0 dist 9.75662 6.89817 7.85301 5.73619 11.0532 9.31742 numMergedOcc 0
15 mol 203 unq 1 iso 0 dist 9.58178 9.31742 6.40721 5.73619 10.3373 6.89817 numMergedOcc 0
16 mol 203 unq 2 iso 0 dist 9.52542 9.31742 4.76871 5.73619 9.80432 6.89817 numMergedOcc 0
17 mol 203 unq 3 iso 0 dist 9.80432 6.89817 4.76871 5.73619 9.52542 9.31742 numMergedOcc 0
18 mol 203 unq 4 iso 0 dist 6.86448 6.89817 5.81172 5.73619 11.7195 9.31742 numMergedOcc 0
19 mol 272 unq 0 iso 0 dist 8.19595 5.9131 3.93924 13.7606 8.56255 8.16917 numMergedOcc 0
20 mol 272 unq 1 iso 0 dist 4.87063 8.16917 4.49309 13.7606 10.3826 5.9131 numMergedOcc 0
21 mol 272 unq 2 iso 0 dist 8.56255 8.16917 3.93924 13.7606 8.19595 5.9131 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 7.7368 5.62568 5.1517 12.8716 13.3409 8.82948 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 7.7368 5.62568 5.1517 12.8716 13.3409 8.82948 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 7.7368 5.62568 5.1517 12.8716 13.3409 8.82948 numMergedOcc 0
