0 mol 10 unq 0 iso 0 dist 9.31452 7.99404 8.65597 3.5691 8.98746 6.68744 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 7.88321 9.68539 4.89559 3.47751 9.1568 11.5874 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 7.88704 7.80113 11.1337 3.71967 9.98298 9.82018 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 7.88704 7.80113 11.1337 6.15397 7.55036 11.8212 numMergedOcc 0
4 mol 83 unq 2 iso 0 dist 7.88704 7.80113 11.1337 13.8225 8.32248 18.875 numMergedOcc 0
5 mol 83 unq 3 iso 0 dist 9.05437 9.33202 5.36222 16.9252 9.98298 14.3917 numMergedOcc 0
6 mol 83 unq 4 iso 0 dist 9.05437 9.33202 5.36222 12.9907 7.55036 12.6245 numMergedOcc 0
7 mol 83 unq 5 iso 0 dist 9.05437 9.33202 5.36222 3.91658 8.32248 10.6272 numMergedOcc 0
8 mol 83 unq 6 iso 0 dist 9.00625 6.55004 5.36222 16.7395 9.98298 14.3917 numMergedOcc 0
9 mol 83 unq 7 iso 0 dist 9.00625 6.55004 5.36222 14.1991 7.55036 12.6245 numMergedOcc 0
10 mol 83 unq 8 iso 0 dist 9.00625 6.55004 5.36222 8.33755 8.32248 10.6272 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 8.85708 9.33403 8.93179 13.3692 8.16392 16.977 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.53875 6.32669 8.28737 12.4943 7.43045 13.6241 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.53875 6.32669 8.28737 6 7.74168 5.18805 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 8.53875 6.32669 8.28737 8.90391 8.16507 7.11158 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 7.18997 5.40655 4.66784 3.82689 7.35584 4.91046 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 7.97667 9.89938 8.15312 8.689 6.47726 11.3345 numMergedOcc 0
17 mol 212 unq 1 iso 0 dist 8.85976 9.66798 3.81896 6.22585 9.20546 11.7892 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 7.86364 7.0795 5.29135 3.42123 8.92555 8.13294 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 8.6462 8.22353 4.3101 11.7178 7.7096 9.47603 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 7.67032 4.75866 10.8666 9.78358 5.16266 14.005 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.69083 8.80555 5.2842 13.6006 9.33601 8.91437 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 5.96202 8.80418 5.2842 6.35533 9.33601 8.91437 numMergedOcc 0
