0 mol 0 unq 0 iso 0 dist 7.20999 5.56011 7.65806 13.6767 9.19007 9.64573 11.0785 6.0225 9.72725 6.94943 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 7.15434 11.2706 7.10621 7.29541 5.72491 5.44992 13.6482 7.12508 6.1206 8.15894 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 12.1567 6.72502 6.58998 11.6434 5.11636 7.95042 8.24948 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.20058 14.9411 8.38394 12.1567 6.72502 6.59374 11.6434 5.11636 10.9819 8.24948 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.51406 6.4487 8.34347 6.81213 5.69955 10.6756 12.4917 8.25132 13.6027 6.73167 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 7.51406 6.4487 8.34347 6.81213 5.69955 10.6756 10.483 4.94205 12.8365 7.40948 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 8.33667 9.93832 9.06158 13.0289 10.8828 10.0168 7.24352 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 8.05602 12.0507 5.08437 14.9908 7.26086 7.32662 9.55337 3.9764 5.10496 8.75597 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 8.05602 4.72129 6.48948 14.9908 7.26086 13.4985 9.55337 3.9764 5.92242 8.75597 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 8.05602 12.0339 6.10456 14.9908 7.26086 6.934 9.55337 3.9764 5.2571 8.75597 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.88255 10.5726 8.73993 6.89245 7.77116 3.78311 6.88175 6.9194 12.31 9.6121 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 8.88255 10.5726 8.73993 6.89245 7.77116 3.78311 14.8889 9.68677 7.64052 9.57341 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 8.99949 11.3502 6.85062 14.8405 9.29384 9.32969 19.8448 12.6005 14.4508 6.78801 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 11.2674 8.84507 6.74196 7.97027 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 12.7466 8.67203 11.4707 6.81955 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 10.656 6.02502 8.36842 4.9876 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 11.2986 8.38865 11.0628 10.4038 4.1511 9.91384 5.28771 numMergedOcc 0
17 mol 227 unq 1 iso 0 dist 9.60159 6.38287 7.09863 11.2986 8.38865 12.9587 10.4038 4.1511 10.3016 5.28771 numMergedOcc 0
18 mol 227 unq 2 iso 0 dist 7.71761 5.841 7.55216 8.14937 5.87815 10.6244 13.4351 5.73883 12.2073 9.71916 numMergedOcc 0
19 mol 230 unq 0 iso 0 dist 5.62804 6.33989 6.7547 10.1088 6.41286 6.20661 14.0318 9.70574 12.3973 7.07833 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.8902 12.3593 9.17653 5.86656 6.14323 13.0621 11.1879 13.2035 19.5824 7.14086 numMergedOcc 0
