0 mol 20 unq 0 iso 0 dist 9.4228 5.65401 8.81141 16.7341 9.74724 12.674 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 9.4228 5.65401 8.81141 14.3516 9.13347 9.77882 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.80127 4.33963 4.87192 6.7846 7.18124 4.21283 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.80127 4.33963 4.87192 8.03955 6.47026 4.97191 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.48457 11.2106 4.87192 13.2846 7.18124 4.21283 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.48457 11.2106 4.87192 12.3897 6.47026 4.97191 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.18809 8.53692 5.44028 10.9724 8.32093 13.0221 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 4.69674 5.71772 8.31442 4.7874 6.48394 3.76156 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 8.77199 6.37974 6.00564 13.3089 9.43843 14.3481 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 8.77199 6.37974 6.00564 10.3737 7.67463 4.06365 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 8.81824 5.08358 6.00564 16.2205 9.43843 14.3481 numMergedOcc 0
11 mol 85 unq 3 iso 0 dist 8.81824 5.08358 6.00564 8.37717 7.67463 4.06365 numMergedOcc 0
12 mol 91 unq 0 iso 0 dist 7.37948 8.1837 9.29087 13.2837 6.69121 14.0343 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 5.82487 12.4467 8.97819 11.6076 8.46167 14.091 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 5.82487 12.4467 8.97819 7.84907 6.13175 14.6197 numMergedOcc 0
15 mol 113 unq 2 iso 0 dist 5.82487 12.4467 8.97819 4.11536 4.34107 12.8965 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.48488 5.45934 6.00293 8.36443 9.67872 5.21512 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 7.23959 5.54129 5.96238 6.49049 8.42716 6.72925 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 7.23959 5.28092 7.85966 6.49049 8.42716 10.2944 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 8.89057 4.82788 5.04032 6.3912 7.8605 4.12133 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 8.89057 6.20156 8.48397 6.3912 7.8605 10.1357 numMergedOcc 0
21 mol 285 unq 2 iso 0 dist 7.97266 8.42446 5.04032 12.3871 7.8605 4.12133 numMergedOcc 0
22 mol 285 unq 3 iso 0 dist 7.97266 7.06919 8.48397 12.3871 7.8605 10.1357 numMergedOcc 0
