0 mol 24 unq 0 iso 0 dist 6.77987 6.50899 8.31631 8.10063 6.75063 8.9776 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 5.84349 3.82411 4.64187 5.31968 6.23577 7.89306 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 5.84349 4.28598 7.95437 5.31968 6.23577 8.36697 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 9.15499 3.96491 9.59073 7.79508 10.9062 4.07334 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 8.53833 11.1855 8.78414 12.6158 5.74753 6.89855 numMergedOcc 0
5 mol 63 unq 1 iso 0 dist 8.53833 11.1855 8.78414 7.10403 5.82517 7.85738 numMergedOcc 0
6 mol 63 unq 2 iso 0 dist 9.6401 6.63195 8.78414 8.17492 5.74753 6.89855 numMergedOcc 0
7 mol 63 unq 3 iso 0 dist 9.6401 6.63195 8.78414 12.3166 5.82517 7.85738 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 8.8014 14.9646 8.71074 17.445 9.4465 5.26566 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 9.77648 17.1322 9.08745 23.3079 15.9536 7.17133 numMergedOcc 0
10 mol 69 unq 1 iso 0 dist 9.18161 6.25587 9.08745 10.0903 15.9536 7.17133 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 6.22872 5.86721 4.27766 10.4028 5.75925 4.8983 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 8.52697 8.47393 9.04293 13.2324 11.5374 6.65972 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 6.24296 3.81285 4.29937 6.27877 8.08787 7.51319 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.24296 3.81285 4.29937 10.5834 11.053 9.43839 numMergedOcc 0
15 mol 85 unq 2 iso 0 dist 6.24296 6.17121 5.37869 14.5265 12.4236 8.66427 numMergedOcc 0
16 mol 85 unq 3 iso 0 dist 6.24296 6.17121 5.37869 6.27877 8.08787 8.49887 numMergedOcc 0
17 mol 85 unq 4 iso 0 dist 6.83218 3.81285 3.65628 6.27877 10.4844 7.51319 numMergedOcc 0
18 mol 85 unq 5 iso 0 dist 6.83218 3.81285 3.65628 10.5834 7.97629 9.43839 numMergedOcc 0
19 mol 85 unq 6 iso 0 dist 6.83218 6.17121 4.05415 14.5265 9.61831 8.66427 numMergedOcc 0
20 mol 85 unq 7 iso 0 dist 6.83218 6.17121 4.05415 6.27877 10.4844 8.49887 numMergedOcc 0
21 mol 91 unq 0 iso 0 dist 6.64714 9.46631 7.71625 8.01351 5.09341 8.91998 numMergedOcc 0
22 mol 93 unq 0 iso 0 dist 9.43355 13.6305 6.67678 14.0704 5.84807 8.55758 numMergedOcc 0
23 mol 93 unq 1 iso 0 dist 9.43355 14.1431 7.24956 14.0704 5.84807 7.44027 numMergedOcc 0
24 mol 141 unq 0 iso 0 dist 5.24228 6.46148 5.95801 5.68406 4.62155 8.12558 numMergedOcc 0
25 mol 251 unq 0 iso 0 dist 5.85851 3.46172 7.72528 7.73217 5.04918 8.15014 numMergedOcc 0
26 mol 251 unq 1 iso 0 dist 5.85851 3.46172 7.72528 9.34956 12.3351 6.06154 numMergedOcc 0
