0 mol 89 unq 0 iso 0 dist 9.46197 5.44941 9.1784 10.5418 6.19663 9.21227 numMergedOcc 0
1 mol 99 unq 0 iso 0 dist 9.49001 9.15595 9.39801 15.7916 9.40959 8.86001 numMergedOcc 0
2 mol 99 unq 1 iso 0 dist 9.49001 6.73829 6.02154 15.7916 9.40959 9.36749 numMergedOcc 0
3 mol 99 unq 2 iso 0 dist 7.55765 5.91888 4.82346 13.7855 6.83905 8.86001 numMergedOcc 0
4 mol 99 unq 3 iso 0 dist 7.55765 10.0064 8.07233 13.7855 6.83905 9.36749 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 5.30577 10.6016 9.96269 6.60484 4.27067 6.13301 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.0655 4.42019 8.8894 7.81733 4.47584 8.67028 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.32304 6.8279 6.45169 11.5559 6.66108 6.66749 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 7.56048 6.08354 4.62366 15.0355 11.8723 9.39643 numMergedOcc 0
9 mol 172 unq 0 iso 0 dist 9.91479 13.0825 7.77643 21.9773 14.8533 9.4252 numMergedOcc 0
10 mol 172 unq 1 iso 0 dist 9.91479 12.1824 4.90175 13.3634 4.71027 8.52605 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 6.45589 6.51571 5.77828 8.83225 5.05275 7.90344 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.87704 4.828 7.80073 9.73021 4.81796 9.10967 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 7.90944 14.6255 7.10828 11.965 4.74711 6.31114 numMergedOcc 0
14 mol 239 unq 2 iso 0 dist 9.11375 16.0386 7.80073 8.47364 4.81796 9.10967 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 8.38819 8.75845 5.34803 6.76991 4.60751 6.87981 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 5.37738 10.6569 6.40125 16.5306 12.0817 8.62043 numMergedOcc 0
