0 mol 1 unq 0 iso 0 dist 7.4868 7.52834 8.21384 6.36522 6.28298 9.62879 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 6.19084 9.89704 9.81193 11.7226 9.61868 8.16059 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.0478 10.6593 5.7405 7.34695 5.01159 6.10175 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.25041 6.27103 9.32664 14.5293 14.4038 9.94756 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 5.70431 10.9987 9.03987 12.6268 7.72958 6.71332 numMergedOcc 0
5 mol 71 unq 1 iso 0 dist 5.70431 10.9987 9.03987 8.25891 5.86791 4.87423 numMergedOcc 0
6 mol 71 unq 2 iso 0 dist 5.70431 10.9987 9.03987 12.0736 9.2661 4.76283 numMergedOcc 0
7 mol 71 unq 3 iso 0 dist 5.70431 5.14057 8.63476 8.25891 5.86791 7.75237 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 8.41086 6.56678 9.37051 10.7887 4.36082 9.38035 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 7.41599 8.15855 9.37051 8.57865 4.36082 9.38035 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 7.95423 11.8492 9.2657 13.4009 7.74181 6.6081 numMergedOcc 0
11 mol 125 unq 1 iso 0 dist 7.95423 11.8492 9.2657 13.6782 8.27647 9.64304 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.45931 5.49686 7.35385 5.77703 13.1683 8.51265 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.49728 13.8322 7.35385 19.0247 13.1683 8.51265 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 6.35397 5.49686 8.35864 5.77703 9.00056 8.51265 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 5.11863 3.95306 5.0207 6.66619 4.84884 5.13722 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 5.92785 9.14602 5.0207 10.3667 4.84884 5.13722 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 7.35424 8.0557 9.99783 10.3436 6.75301 7.72242 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 6.74767 7.83238 9.9144 8.01717 4.63072 8.66222 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 7.06589 14.3975 9.6479 14.9686 10.5693 9.35766 numMergedOcc 0
20 mol 253 unq 1 iso 0 dist 8.70383 12.7693 9.6479 18.1056 10.5693 9.35766 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 8.95444 9.56036 7.40057 15.7851 12.3321 8.11884 numMergedOcc 0
22 mol 256 unq 1 iso 0 dist 7.53508 13.694 7.40057 19.7336 12.3321 8.11884 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 7.37358 10.6703 8.16582 9.38614 4.99186 8.76889 numMergedOcc 0
24 mol 279 unq 1 iso 0 dist 7.37358 10.6703 8.16582 14.0128 8.17282 7.04397 numMergedOcc 0
