0 mol 18 unq 0 iso 0 dist 9.7728 10.3745 7.94376 5.03976 9.14029 8.80193 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 6.29267 11.9735 7.56495 18.9341 12.7451 9.63599 numMergedOcc 0
2 mol 79 unq 1 iso 0 dist 6.29267 11.9735 7.56495 13.1885 7.82927 8.01743 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 8.15861 4.32784 8.04853 7.46478 10.803 6.05495 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 7.53591 7.84926 9.62774 12.9661 9.53687 8.00449 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 8.34503 6.13227 9.62774 11.978 9.53687 8.00449 numMergedOcc 0
6 mol 146 unq 0 iso 0 dist 8.91908 12.5781 6.73137 14.82 6.19717 6.50043 numMergedOcc 0
7 mol 146 unq 1 iso 0 dist 8.91908 9.68961 5.95148 14.82 6.19717 9.44952 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 8.24681 6.4617 4.6512 11.1992 5.30823 9.6096 numMergedOcc 0
9 mol 158 unq 1 iso 0 dist 6.51748 6.99918 4.6512 7.63085 5.30823 9.6096 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 5.86468 6.01155 5.12964 11.6608 9.74321 9.75763 numMergedOcc 0
11 mol 184 unq 1 iso 0 dist 5.86468 6.01155 5.12964 10.5135 5.06572 7.0685 numMergedOcc 0
12 mol 184 unq 2 iso 0 dist 5.86468 6.01155 5.12964 4.54491 3.88336 6.44904 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.00382 5.48326 8.2241 7.55974 6.54455 8.97471 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 9.2684 6.33919 7.63543 9.28273 11.7541 9.71152 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 8.4625 13.0927 9.25759 15.272 8.99193 5.59555 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 8.4625 13.0927 9.25759 15.272 8.99193 5.59555 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 8.4625 13.0927 9.25759 15.272 8.99193 5.59555 numMergedOcc 0
18 mol 294 unq 0 iso 0 dist 4.83062 10.5335 9.01437 13.4457 9.63038 7.36811 numMergedOcc 0
19 mol 294 unq 1 iso 0 dist 8.65363 9.08006 9.01437 14.8228 9.63038 7.36811 numMergedOcc 0
