0 mol 90 unq 0 iso 0 dist 4.48773 4.78804 8.39015 6.88603 5.30537 9.43446 numMergedOcc 0
1 mol 110 unq 0 iso 0 dist 9.94311 11.9992 8.97683 16.2411 7.01157 9.13723 numMergedOcc 0
2 mol 122 unq 0 iso 0 dist 9.71402 6.85647 9.44209 9.55337 7.82677 8.40483 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 8.72028 4.55126 5.34451 14.0108 9.8187 9.66935 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 8.83046 5.40743 6.6175 14.3331 9.6867 8.9891 numMergedOcc 0
5 mol 178 unq 0 iso 0 dist 7.24761 5.50567 7.82796 5.85439 7.66936 8.3134 numMergedOcc 0
6 mol 189 unq 0 iso 0 dist 8.41526 7.43173 8.80847 11.8962 6.90034 9.86267 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 8.91205 9.17866 5.69866 12.0992 5.17358 5.40592 numMergedOcc 0
8 mol 226 unq 0 iso 0 dist 4.67943 5.73852 9.05082 10.9625 12.1713 6.44662 numMergedOcc 0
9 mol 274 unq 0 iso 0 dist 6.89781 11.0263 9.96645 10.308 6.13137 5.12523 numMergedOcc 0
10 mol 274 unq 1 iso 0 dist 6.89781 13.0361 9.29005 8.38395 5.18671 5.42845 numMergedOcc 0
11 mol 274 unq 2 iso 0 dist 6.89781 9.7346 8.16746 8.38395 5.18671 5.62484 numMergedOcc 0
