0 mol 26 unq 0 iso 0 dist 8.62527 9.7522 4.52042 4.21886 8.65828 9.80897 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 5.68877 7.10899 4.30086 5.70643 4.50643 7.78892 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.34361 5.97635 5.65405 14.1632 6.29755 9.89662 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 8.34361 5.97635 5.65405 15.4599 7.4038 11.7963 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 7.49861 8.99491 11.6779 4.69203 5.45684 8.75668 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 7.49861 8.99491 11.6779 5.59746 7.66372 12.8796 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 6.2165 8.99491 10.1207 4.69203 7.76644 8.75668 numMergedOcc 0
7 mol 64 unq 3 iso 0 dist 6.2165 8.99491 10.1207 5.59746 9.99743 12.8796 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.18252 4.50572 11.8887 17.3577 9.20236 20.7325 numMergedOcc 0
9 mol 110 unq 0 iso 0 dist 6.34794 7.09405 4.98189 4.37836 9.00302 7.32156 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.87592 4.98864 5.19652 4.64507 9.47253 9.54842 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 8.37388 7.95871 5.19652 6.90898 9.47253 9.54842 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 8.37388 9.80286 11.5824 6.90898 9.47253 16.1613 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 8.5081 7.26897 10.7202 11.6037 6.86189 16.3987 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 7.49276 4.44292 4.97552 5.49557 9.06599 8.57712 numMergedOcc 0
15 mol 229 unq 0 iso 0 dist 9.33775 8.6537 10.8091 11.9181 9.42877 13.4233 numMergedOcc 0
16 mol 229 unq 1 iso 0 dist 9.33775 8.75374 7.3983 11.9181 9.42877 13.6079 numMergedOcc 0
17 mol 229 unq 2 iso 0 dist 9.33775 7.10634 5.87361 11.9181 9.42877 13.8028 numMergedOcc 0
18 mol 229 unq 3 iso 0 dist 9.33775 5.57702 10.9466 11.9181 9.42877 15.9876 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 8.52954 7.08539 12.2063 4.11428 7.30003 10.471 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.83646 9.94315 10.1036 5.64173 7.75366 4.80834 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 7.30582 8.40773 9.64766 8.94039 8.00841 14.8408 numMergedOcc 0
22 mol 244 unq 0 iso 0 dist 8.19381 7.65388 8.82711 8.49995 6.2667 9.21656 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 6.41167 5.73834 5.13233 5.66907 8.73425 9.04358 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 6.41167 5.73834 5.13233 9.6053 9.65711 10.0455 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 6.43775 7.36905 6.46871 4.39302 7.27155 9.77155 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 6.43775 6.83408 6.62911 4.39302 7.27155 10.1365 numMergedOcc 0
27 mol 271 unq 0 iso 0 dist 8.54162 9.56149 5.31774 5.60228 5.76281 9.42899 numMergedOcc 0
