0 mol 11 unq 0 iso 0 dist 6.79478 5.15125 4.30695 10.9655 6.35398 7.0964 8.3846 7.27724 7.56871 12.9286 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.79478 10.9655 6.35398 5.15125 4.30695 7.0964 14.4856 7.85924 9.09091 11.7385 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 4.98104 9.52463 6.95572 6.07224 7.38677 6.36037 13.785 9.32974 6.72712 12.1654 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 4.98104 9.52463 6.95572 6.07224 7.38677 6.36037 11.3299 6.99832 5.39745 10.8154 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 8.97145 4.17212 8.70296 13.6005 9.25558 14.5627 10.6766 7.90484 9.2235 17.1418 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 6.5874 9.64263 8.70296 5.55307 9.25558 14.5627 13.552 7.90484 9.2235 17.1418 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 6.5228 5.14857 5.62052 5.26692 7.90563 6.35752 11.3799 4.91422 9.15377 12.128 numMergedOcc 0
7 mol 135 unq 1 iso 0 dist 6.5228 5.26692 7.90563 5.14857 5.62052 6.35752 10.14 7.66205 7.12936 10.2898 numMergedOcc 0
8 mol 174 unq 0 iso 0 dist 8.76218 11.8159 9.87122 10.886 8.87569 4.17687 11.1631 8.37744 7.47932 10.1869 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 7.44191 11.2787 6.59025 6.70394 6.46704 9.87773 14.3261 7.07409 6.32777 11.5642 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 6.00053 5.87168 6.59025 10.8517 6.46704 9.87773 9.34615 7.07409 6.32777 11.5642 numMergedOcc 0
11 mol 188 unq 0 iso 0 dist 9.24118 8.98299 8.10214 10.9086 7.14503 9.01338 17.6717 12.0548 9.33696 11.4648 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 7.32478 7.75447 6.72379 5.35575 8.29382 6.7294 10.942 5.38925 9.3402 13.132 numMergedOcc 0
13 mol 194 unq 1 iso 0 dist 9.48439 6.38935 6.72379 7.25062 8.29382 6.7294 11.6958 5.38925 9.3402 13.132 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 9.17826 5.75236 5.41321 16.3489 7.43071 11.362 8.34104 6.43754 7.57454 12.2922 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 5.00515 10.6768 7.32499 6.63685 6.30154 10.0708 10.435 5.9221 7.43663 11.6166 numMergedOcc 0
16 mol 234 unq 1 iso 0 dist 5.00515 10.6768 7.32499 6.63685 6.30154 10.0708 17.6523 13.2297 7.94068 16.7407 numMergedOcc 0
