0 mol 90 unq 0 iso 0 dist 9.56911 5.82417 7.68053 5.36296 8.44515 4.8042 numMergedOcc 0
1 mol 90 unq 0 iso 1 dist 7.68053 5.82417 9.56911 4.8042 8.44515 5.36296 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.03472 3.58204 9.40274 4.56886 5.90776 5.1219 numMergedOcc 0
3 mol 92 unq 0 iso 1 dist 9.40274 3.58204 9.03472 5.1219 5.90776 4.56886 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 5.87592 5.11161 8.37388 6.59772 8.97043 4.86477 numMergedOcc 0
5 mol 115 unq 0 iso 1 dist 8.37388 5.11161 5.87592 4.86477 8.97043 6.59772 numMergedOcc 0
6 mol 185 unq 0 iso 0 dist 7.55408 11.1645 8.38127 8.20407 6.89879 4.83776 numMergedOcc 0
7 mol 185 unq 0 iso 1 dist 8.38127 11.1645 7.55408 4.83776 6.89879 8.20407 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 7.43427 8.27713 7.50841 5.53181 4.851 5.02331 numMergedOcc 0
9 mol 218 unq 0 iso 1 dist 7.50841 8.27713 7.43427 5.02331 4.851 5.53181 numMergedOcc 0
10 mol 250 unq 0 iso 0 dist 8.52434 5.62511 8.63767 5.45802 7.63152 3.78208 numMergedOcc 0
11 mol 250 unq 0 iso 1 dist 8.63767 5.62511 8.52434 3.78208 7.63152 5.45802 numMergedOcc 0
12 mol 265 unq 0 iso 0 dist 8.70514 5.78969 8.6462 4.39816 8.57445 7.73011 numMergedOcc 0
13 mol 265 unq 0 iso 1 dist 8.6462 5.78969 8.70514 7.73011 8.57445 4.39816 numMergedOcc 0
14 mol 276 unq 0 iso 0 dist 9.51947 4.22267 8.9021 4.80779 9.64575 6.32567 numMergedOcc 0
15 mol 276 unq 0 iso 1 dist 8.9021 4.22267 9.51947 6.32567 9.64575 4.80779 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 8.12461 5.96716 9.027 5.58906 8.82899 4.84657 numMergedOcc 0
17 mol 277 unq 0 iso 1 dist 9.027 5.96716 8.12461 4.84657 8.82899 5.58906 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 8.8643 10.7301 5.90456 7.84864 8.68797 11.6042 numMergedOcc 0
19 mol 279 unq 0 iso 1 dist 5.90456 10.7301 8.8643 11.6042 8.68797 7.84864 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 9.24895 12.7877 8.34154 4.79698 5.70546 10.5081 numMergedOcc 0
21 mol 279 unq 1 iso 1 dist 8.34154 12.7877 9.24895 10.5081 5.70546 4.79698 numMergedOcc 0
