0 mol 25 unq 0 iso 0 dist 8.94828 15.6642 7.17969 12.2829 5.59268 8.88413 15.5398 7.92503 5.30154 7.05148 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 9.56181 7.70414 9.67592 6.48746 4.96726 8.99491 5.40109 9.97159 6.21578 6.23138 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 8.07365 14.1188 7.27724 6.82522 5.33325 9.65047 11.756 12.1092 11.4333 9.49995 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 6.86713 9.70895 8.03644 9.89353 5.69671 9.65047 5.04455 9.49454 11.4333 9.49995 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 8.66715 14.0905 7.11802 12.5406 6.26797 5.86531 17.5205 9.22661 5.92062 6.42904 numMergedOcc 0
5 mol 133 unq 1 iso 0 dist 9.00172 14.0905 8.00618 12.5406 9.73435 5.86531 17.5205 13.5028 5.92062 6.42904 numMergedOcc 0
6 mol 133 unq 2 iso 0 dist 8.95433 11.0811 7.11802 13.6484 6.26797 5.86531 12.0166 9.22661 5.92062 6.42904 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 8.57514 12.397 7.45763 12.7057 4.2475 6.752 7.35197 4.8668 5.8535 7.23557 numMergedOcc 0
8 mol 205 unq 1 iso 0 dist 8.57514 12.397 7.45763 14.4031 6.8901 5.4913 7.35197 4.8668 5.8535 8.86587 numMergedOcc 0
9 mol 205 unq 2 iso 0 dist 6.11505 11.3225 7.45763 9.86224 4.2475 6.752 5.68053 4.8668 5.8535 7.23557 numMergedOcc 0
10 mol 205 unq 3 iso 0 dist 6.11505 11.3225 7.45763 12.7533 6.8901 5.4913 5.68053 4.8668 5.8535 8.86587 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 8.58471 10.3518 6.18308 11.8094 3.84723 8.62103 17.9368 11.18 10.4168 9.26092 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 7.57253 9.29407 8.27212 12.0485 9.60401 9.29752 19.1161 13.7227 12.5452 9.41148 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 7.57253 9.29407 8.27212 12.0485 9.60401 9.29752 5.70548 9.05071 8.80479 7.83422 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 5.77925 12.1686 9.99038 18.1054 15.1664 6.11137 18.3381 17.3964 9.52712 8.37813 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 5.77925 12.1686 9.99038 18.1054 15.1664 6.11137 12.2708 10.9744 4.79879 9.25988 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.2067 9.88911 6.42289 14.5631 7.52881 5.73834 11.8793 11.2102 5.63675 8.63176 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 7.37999 11.0659 6.24356 10.875 3.93713 8.19504 10.9458 7.16853 5.00209 9.3201 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 7.36703 5.91731 6.24356 11.0689 3.93713 8.19504 6.24807 7.16853 5.00209 9.3201 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 9.13226 10.7073 7.56915 11.0807 5.9882 9.71801 8.85159 9.85289 6.20558 9.02071 numMergedOcc 0
