0 mol 76 unq 0 iso 0 dist 5.17291 8.1489 9.19822 8.27493 9.13322 11.6904 numMergedOcc 0
1 mol 98 unq 0 iso 0 dist 9.48388 6.91361 14.5341 4.54306 7.78931 6.83746 numMergedOcc 0
2 mol 98 unq 1 iso 0 dist 9.48388 6.91361 14.5341 10.9661 8.7497 11.6715 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 7.85025 4.92106 5.74088 13.4842 8.77023 11.9059 numMergedOcc 0
4 mol 134 unq 0 iso 0 dist 7.31419 5.10248 6.02179 6.4405 5.35237 8.48313 numMergedOcc 0
5 mol 134 unq 1 iso 0 dist 7.31419 5.10248 6.02179 3.64555 8.70621 6.99345 numMergedOcc 0
6 mol 170 unq 0 iso 0 dist 7.665 5.42919 5.95519 5.03025 9.08274 5.13268 numMergedOcc 0
7 mol 184 unq 0 iso 0 dist 7.54454 9.8189 5.16512 6.63528 9.90822 13.1226 numMergedOcc 0
8 mol 184 unq 1 iso 0 dist 7.54454 9.8189 5.16512 3.75201 6.73504 7.32888 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 9.30186 9.34695 17.0241 6.38826 8.1945 9.57955 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 4.94074 9.63438 8.2372 7.83075 8.51625 11.6407 numMergedOcc 0
11 mol 264 unq 0 iso 0 dist 8.43682 8.43465 6.84156 4.66338 9.19754 6.02757 numMergedOcc 0
12 mol 264 unq 1 iso 0 dist 6.20796 8.43465 9.37297 4.66338 8.29262 6.02757 numMergedOcc 0
13 mol 292 unq 0 iso 0 dist 7.29148 9.96482 7.61567 14.9639 9.9182 14.5087 numMergedOcc 0
14 mol 292 unq 1 iso 0 dist 7.29148 9.96482 7.61567 13.1177 8.9221 16.4438 numMergedOcc 0
15 mol 292 unq 2 iso 0 dist 6.02089 9.97806 6.27903 6.38012 9.90967 15.5008 numMergedOcc 0
16 mol 292 unq 3 iso 0 dist 6.02089 9.97806 6.27903 6.03672 9.9886 12.7596 numMergedOcc 0
17 mol 292 unq 4 iso 0 dist 6.87804 9.97806 15.2894 4.77692 7.20674 12.0857 numMergedOcc 0
18 mol 292 unq 5 iso 0 dist 6.87804 9.97806 15.2894 6.38012 8.38121 15.5008 numMergedOcc 0
