0 mol 1 unq 0 iso 0 dist 5.87976 8.3673 5.06184 11.5998 11.2596 7.68226 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.88556 9.06787 7.7687 18.2881 14.4459 9.31516 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.19959 8.85892 3.37815 5.93093 6.36178 5.79157 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 7.66459 9.54537 10.0429 6.68601 11.7741 6.89706 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.91055 7.15918 5.82228 4.77259 9.28585 8.48639 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.94991 9.27894 6.44712 5.05933 10.8851 7.77953 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 7.80661 6.31404 10.7383 10.6213 14.2761 7.11411 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.39622 5.09756 3.6848 6.28015 9.71223 9.82338 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 5.39622 7.44523 5.33968 6.28015 9.71223 7.99933 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 7.83389 7.1329 3.81315 9.77528 7.252 7.578 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 7.83389 7.1329 3.81315 4.86985 10.957 9.24926 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.05227 5.65314 10.9673 8.66994 16.5872 9.68213 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 8.78004 9.9922 15.6572 3.86707 11.0244 6.5608 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 9.60654 9.48525 16.0311 11.4962 18.1662 9.0735 numMergedOcc 0
14 mol 225 unq 1 iso 0 dist 7.11262 9.48525 6.04066 11.4962 12.0014 9.0735 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 9.6748 7.42359 6.76489 11.9134 9.19579 8.07313 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 8.71177 7.42359 3.72181 11.9134 11.6561 8.07313 numMergedOcc 0
17 mol 243 unq 2 iso 0 dist 6.5095 6.02146 7.64134 4.57371 8.89116 7.89993 numMergedOcc 0
18 mol 243 unq 3 iso 0 dist 5.1766 6.02146 10.4256 4.57371 8.28364 7.89993 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 8.79012 8.52702 17.1277 12.6808 19.1893 7.88296 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 8.40448 8.93379 6.77003 4.80106 4.75866 5.60922 numMergedOcc 0
