0 mol 17 unq 0 iso 0 dist 9.84064 8.84341 16.4709 6.20094 15.7729 5.16502 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 9.84064 8.84341 16.4709 8.77993 16.686 8.26398 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 7.96836 7.02884 13.5569 7.57677 13.2523 5.16502 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 7.96836 7.02884 13.5569 4.43871 6.64199 8.26398 numMergedOcc 0
4 mol 17 unq 4 iso 0 dist 7.66522 8.84341 13.9821 6.20094 11.5708 5.16502 numMergedOcc 0
5 mol 17 unq 5 iso 0 dist 7.66522 8.84341 13.9821 8.77993 8.90155 8.26398 numMergedOcc 0
6 mol 17 unq 6 iso 0 dist 8.49309 7.02884 13.9821 7.57677 11.5708 5.16502 numMergedOcc 0
7 mol 17 unq 7 iso 0 dist 8.49309 7.02884 13.9821 4.43871 8.90155 8.26398 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 6.85245 9.53735 5.60332 12.9455 6.70325 9.82851 numMergedOcc 0
9 mol 26 unq 1 iso 0 dist 8.43571 9.34599 5.60332 5.34406 6.70325 9.82851 numMergedOcc 0
10 mol 26 unq 2 iso 0 dist 8.43571 6.32127 7.30207 5.34406 6.70325 9.11311 numMergedOcc 0
11 mol 28 unq 0 iso 0 dist 7.84931 6.68029 7.09981 6.20494 10.2266 5.19518 numMergedOcc 0
12 mol 28 unq 1 iso 0 dist 6.64392 6.44166 7.09981 7.05692 10.2266 5.19518 numMergedOcc 0
13 mol 54 unq 0 iso 0 dist 9.1695 5.0478 11.6507 8.69776 11.9682 5.27979 numMergedOcc 0
14 mol 83 unq 0 iso 0 dist 8.9024 6.07433 11.4438 7.20975 12.341 8.99451 numMergedOcc 0
15 mol 87 unq 0 iso 0 dist 9.99609 7.14461 4.99645 5.77895 9.20673 9.41934 numMergedOcc 0
16 mol 87 unq 1 iso 0 dist 7.08616 7.14461 10.6701 5.77895 12.7761 9.41934 numMergedOcc 0
17 mol 87 unq 2 iso 0 dist 7.83182 7.14461 7.79329 5.77895 13.0861 9.41934 numMergedOcc 0
18 mol 103 unq 0 iso 0 dist 7.68908 6.87901 10.3138 5.99213 11.5009 5.51053 numMergedOcc 0
19 mol 103 unq 1 iso 0 dist 7.95587 6.87901 8.49357 5.99213 9.0807 5.51053 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 7.75233 9.58371 11.5292 13.3796 17.626 9.45696 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 7.82113 6.1338 5.01686 5.20357 7.50005 8.4784 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 8.96503 9.47112 4.79372 8.98996 4.93303 6.81516 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 8.96503 9.47112 4.79372 17.5993 10.1326 9.17562 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.67562 8.37652 8.25682 4.94807 9.9582 6.24462 numMergedOcc 0
25 mol 254 unq 0 iso 0 dist 9.61808 9.00866 6.5652 16.1872 15.9006 9.50951 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 7.7368 5.62568 5.1517 10.0544 12.5296 7.99204 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 7.7368 5.62568 5.1517 10.0544 12.5296 7.99204 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 7.7368 5.62568 5.1517 10.0544 12.5296 7.99204 numMergedOcc 0
