0 mol 4 unq 0 iso 0 dist 6.59244 4.98902 8.39239 6.47885 5.30385 7.27909 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.59244 4.98902 8.39239 9.57968 9.77024 5.61191 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 7.86299 6.11711 8.09534 6.3554 9.88198 12.158 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 7.63146 5.96117 7.93279 7.25071 8.36387 11.9446 numMergedOcc 0
4 mol 11 unq 2 iso 0 dist 7.63146 5.96117 7.93279 10.3787 9.99647 7.51068 numMergedOcc 0
5 mol 41 unq 0 iso 0 dist 6.68599 10.7817 7.89705 13.8714 9.18836 6.32189 numMergedOcc 0
6 mol 41 unq 1 iso 0 dist 6.68599 10.7817 7.89705 7.50942 6.07294 4.85777 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.23755 7.65955 5.14178 15.0981 6.82707 9.43915 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 7.40582 8.53005 5.22996 16.1172 8.96747 12.0757 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 8.98532 9.93828 9.08316 10.2731 6.15654 5.43086 numMergedOcc 0
10 mol 92 unq 2 iso 0 dist 8.98532 9.93828 9.08316 4.66752 7.89887 6.04936 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 8.55572 5.75923 4.83761 8.13727 9.18949 5.6462 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 7.94925 5.6183 7.50206 5.8344 6.51968 8.06011 numMergedOcc 0
13 mol 128 unq 1 iso 0 dist 7.94925 5.6183 7.50206 10.172 7.61237 5.19611 numMergedOcc 0
14 mol 128 unq 2 iso 0 dist 7.94925 9.00257 6.4028 5.8344 6.51968 6.42135 numMergedOcc 0
15 mol 128 unq 3 iso 0 dist 7.94925 9.00257 6.4028 10.172 7.61237 4.68499 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 9.66794 10.7384 9.53031 5.60968 9.26919 10.7591 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.58174 14.2948 9.42862 11.4894 9.23676 7.34336 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.49961 5.39451 9.36997 9.7952 6.91534 12.5953 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 8.49961 5.39451 9.36997 10.1967 8.67704 10.9512 numMergedOcc 0
20 mol 239 unq 2 iso 0 dist 8.49961 11.0724 9.97907 9.7952 6.91534 11.4843 numMergedOcc 0
21 mol 239 unq 3 iso 0 dist 8.49961 11.0724 9.97907 10.1967 8.67704 7.06824 numMergedOcc 0
22 mol 239 unq 4 iso 0 dist 8.49961 17.1388 8.83751 9.7952 6.91534 13.3917 numMergedOcc 0
23 mol 239 unq 5 iso 0 dist 8.49961 17.1388 8.83751 10.1967 8.67704 14.4176 numMergedOcc 0
24 mol 239 unq 6 iso 0 dist 8.49961 16.0868 8.77688 9.7952 6.91534 9.38172 numMergedOcc 0
25 mol 239 unq 7 iso 0 dist 8.49961 16.0868 8.77688 10.1967 8.67704 9.33091 numMergedOcc 0
26 mol 250 unq 0 iso 0 dist 9.79531 5.92955 5.43238 6.04958 9.5746 6.93529 numMergedOcc 0
27 mol 250 unq 1 iso 0 dist 5.97672 9.35239 9.48115 5.61043 8.85979 14.352 numMergedOcc 0
28 mol 261 unq 0 iso 0 dist 9.66298 12.3844 6.40153 11.7392 6.45102 4.58184 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 9.46926 14.9026 9.98606 15.6565 9.54381 8.62248 numMergedOcc 0
