0 mol 13 unq 0 iso 0 dist 9.18487 9.24347 8.05984 6.54276 7.98465 3.53348 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.88576 5.03226 8.34024 5.78495 7.11053 9.05087 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.17564 13.5189 5.45575 10.8351 8.67634 11.6399 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 7.19213 12.1252 5.45575 8.08163 8.67634 11.6399 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 6.94351 5.30815 5.45575 10.8454 8.67634 11.6399 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.70192 8.1507 9.46792 3.77705 8.96498 9.55917 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 5.70192 8.1507 9.46792 11.7466 7.5228 11.3469 numMergedOcc 0
7 mol 67 unq 2 iso 0 dist 7.65646 4.18156 9.46792 7.64337 8.96498 9.55917 numMergedOcc 0
8 mol 67 unq 3 iso 0 dist 7.65646 4.18156 9.46792 10.1845 7.5228 11.3469 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.46477 5.97074 9.87553 3.79201 5.81771 4.60044 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 8.46477 8.86345 7.42204 3.79201 5.81771 6.29596 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.73897 5.80658 8.49888 3.75291 8.50705 6.95933 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 8.07915 9.67218 9.66935 5.4632 8.42899 12.4577 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 7.97801 9.38956 8.9891 5.36078 8.33721 11.4342 numMergedOcc 0
14 mol 159 unq 0 iso 0 dist 8.94941 14.6041 9.53056 9.84064 8.88492 8.58259 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 9.56248 18.7282 9.25763 15.8873 8.62366 10.1842 numMergedOcc 0
16 mol 173 unq 1 iso 0 dist 9.56248 18.7282 9.25763 14.9274 9.44973 12.4786 numMergedOcc 0
17 mol 173 unq 2 iso 0 dist 9.56248 18.7282 9.25763 9.35913 6.52508 13.8624 numMergedOcc 0
18 mol 173 unq 3 iso 0 dist 9.56248 18.8784 9.63102 15.8873 8.62366 7.24163 numMergedOcc 0
19 mol 173 unq 4 iso 0 dist 9.56248 18.8784 9.63102 14.9274 9.44973 8.98989 numMergedOcc 0
20 mol 173 unq 5 iso 0 dist 9.56248 18.8784 9.63102 9.35913 6.52508 12.0865 numMergedOcc 0
21 mol 195 unq 0 iso 0 dist 7.63511 6.64858 9.30817 3.7157 5.87439 9.26568 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 8.42382 6.07494 8.11377 12.9828 9.8009 16.099 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.24435 4.50991 8.61709 11.7967 8.69525 10.5939 numMergedOcc 0
24 mol 273 unq 0 iso 0 dist 9.79283 12.565 6.06557 12.2057 9.35749 5.35498 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 9.20119 8.64534 5.2527 10.9015 7.52924 6.51505 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 8.96997 4.30142 5.2527 7.77671 7.52924 6.51505 numMergedOcc 0
