0 mol 17 unq 0 iso 0 dist 8.84341 8.77993 8.26398 14.3933 13.5569 6.64199 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.84341 8.77993 8.26398 7.66522 13.9821 8.90155 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 7.02884 4.43871 8.26398 7.96836 13.5569 6.64199 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 7.02884 4.43871 8.26398 8.49309 13.9821 8.90155 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.53735 12.9455 9.82851 6.85245 5.60332 6.70325 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.34599 5.34406 9.82851 8.43571 5.60332 6.70325 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 6.32127 5.34406 9.11311 8.43571 7.30207 6.70325 numMergedOcc 0
7 mol 28 unq 0 iso 0 dist 6.68029 6.20494 5.19518 10.5835 11.6018 9.28621 numMergedOcc 0
8 mol 28 unq 1 iso 0 dist 6.68029 6.20494 5.19518 13.0886 7.07919 8.94643 numMergedOcc 0
9 mol 28 unq 2 iso 0 dist 6.68029 6.20494 5.19518 13.8056 12.4701 8.36195 numMergedOcc 0
10 mol 28 unq 3 iso 0 dist 6.44166 7.05692 5.19518 16.168 11.6018 9.28621 numMergedOcc 0
11 mol 28 unq 4 iso 0 dist 6.44166 7.05692 5.19518 11.1047 7.07919 8.94643 numMergedOcc 0
12 mol 28 unq 5 iso 0 dist 6.44166 7.05692 5.19518 13.9887 12.4701 8.36195 numMergedOcc 0
13 mol 87 unq 0 iso 0 dist 7.14461 5.77895 9.41934 9.99609 4.99645 9.20673 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 6.87901 5.99213 5.51053 7.95587 8.49357 9.0807 numMergedOcc 0
15 mol 103 unq 1 iso 0 dist 6.87901 5.99213 5.51053 11.4817 6.06934 9.70231 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 5.80081 5.22187 4.92382 8.97819 4.1584 5.28634 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.38735 11.0175 5.68985 13.6875 9.12063 8.35588 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 6.1338 5.20357 8.4784 7.82113 5.01686 7.50005 numMergedOcc 0
19 mol 188 unq 1 iso 0 dist 7.47937 7.90572 8.34477 13.9861 9.94001 7.50005 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 9.47112 8.98996 6.81516 8.96503 4.79372 4.93303 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 9.00866 16.1872 9.50951 17.5676 8.65259 7.40957 numMergedOcc 0
22 mol 286 unq 0 iso 0 dist 7.97593 8.51361 9.21276 11.091 5.70349 6.89373 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.52718 6.1158 9.25759 11.1474 9.62532 5.55176 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 9.52718 6.1158 9.25759 11.1474 9.62532 5.55176 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 9.52718 6.1158 9.25759 11.1474 9.62532 5.55176 numMergedOcc 0
