0 mol 92 unq 0 iso 0 dist 6.95572 7.38677 6.36037 6.99832 5.39745 10.8154 7.4729 9.50382 12.7565 5.81965 numMergedOcc 0
1 mol 92 unq 1 iso 0 dist 6.95572 7.38677 6.36037 6.99832 5.39745 10.8154 11.862 11.3858 16.0766 7.06013 numMergedOcc 0
2 mol 92 unq 2 iso 0 dist 6.95572 7.38677 6.36037 6.99832 5.39745 10.8154 6.82344 7.56363 5.91004 9.70512 numMergedOcc 0
3 mol 126 unq 0 iso 0 dist 6.29233 5.42406 4.32209 5.15767 5.14819 6.84245 12.1603 8.01268 10.2072 7.75534 numMergedOcc 0
4 mol 126 unq 1 iso 0 dist 6.29233 5.42406 4.32209 5.15767 5.14819 6.84245 10.4642 6.51507 5.78149 9.06011 numMergedOcc 0
5 mol 126 unq 2 iso 0 dist 5.42406 6.29233 4.32209 5.15767 6.84245 5.14819 12.1603 10.2072 8.01268 7.75534 numMergedOcc 0
6 mol 126 unq 3 iso 0 dist 5.42406 6.29233 4.32209 5.15767 6.84245 5.14819 10.4642 5.78149 6.51507 9.06011 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 9.22661 9.22232 18.2432 4.68409 6.51868 12.3267 7.11802 5.92062 16.0138 7.92688 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 9.22661 7.56378 7.33253 4.68409 6.51868 7.34698 7.11802 5.92062 6.61891 7.92688 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 7.56378 9.22232 15.4484 4.68409 7.34698 12.3267 7.11802 6.61891 16.0138 7.92688 numMergedOcc 0
10 mol 133 unq 3 iso 0 dist 7.56378 9.22661 7.33253 4.68409 7.34698 6.51868 7.11802 6.61891 5.92062 7.92688 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.78652 8.91301 4.30566 6.01455 6.46089 10.1154 10.6877 10.0059 13.1639 7.31468 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 7.78652 8.91301 4.30566 6.01455 6.46089 10.1154 12.7524 8.57817 12.4341 7.7056 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 7.30357 8.61587 6.12113 5.07967 7.30946 11.3161 10.2717 6.14767 12.212 6.88137 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 9.44367 9.47433 16.7026 7.29758 5.81122 13.7525 7.44554 5.4555 11.9952 6.27641 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 6.59025 6.46704 9.87773 7.07409 6.32777 11.5642 10.7062 5.77299 12.2164 7.13543 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 7.99195 9.72611 12.1167 5.86342 9.06217 10.3766 5.98885 6.6251 5.6044 6.94688 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 7.99195 9.72611 12.1167 9.14057 7.13252 10.7723 5.98885 6.6251 5.6044 6.71012 numMergedOcc 0
18 mol 181 unq 3 iso 0 dist 5.9176 6.41453 9.53592 9.60512 5.97685 13.5221 7.63312 5.63555 7.20191 7.98142 numMergedOcc 0
19 mol 181 unq 4 iso 0 dist 5.9176 6.41453 9.53592 13.3389 8.9289 14.5372 7.63312 5.63555 7.20191 7.37327 numMergedOcc 0
20 mol 188 unq 0 iso 0 dist 8.10214 7.14503 9.01338 12.0548 9.33696 11.4648 13.353 10.5721 8.77113 6.90541 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 5.41321 7.43071 11.362 6.43754 7.57454 12.2922 7.22101 10.9607 6.35849 8.17891 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 5.41321 7.43071 11.362 6.43754 7.57454 12.2922 8.65997 9.72615 10.204 6.95902 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 7.32499 6.30154 10.0708 5.9221 7.43663 11.6166 10.3625 10.0059 10.998 9.5707 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 7.32499 6.30154 10.0708 13.2297 7.94068 16.7407 11.0622 5.08515 11.0835 9.39181 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 6.95126 6.21292 10.2834 6.43692 7.95766 12.1942 11.3258 7.60081 16.707 8.21247 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 7.57812 8.69104 6.25098 5.11565 8.90076 6.62002 12.8275 12.2874 7.11984 8.14172 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 7.57812 8.69104 6.25098 5.11565 8.90076 6.62002 10.7456 10.4017 7.95232 6.77463 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 7.57812 8.69104 6.25098 13.171 8.09718 6.73446 13.9668 10.7081 5.50308 6.05141 numMergedOcc 0
29 mol 238 unq 3 iso 0 dist 7.57812 8.69104 6.25098 13.171 8.09718 6.73446 12.8275 12.2874 7.11984 8.09066 numMergedOcc 0
30 mol 238 unq 4 iso 0 dist 7.57812 8.69104 6.25098 13.171 8.09718 6.73446 10.7456 10.4017 7.95232 7.2766 numMergedOcc 0
31 mol 238 unq 5 iso 0 dist 8.69104 7.57812 6.25098 5.11565 6.62002 8.90076 12.8275 7.11984 12.2874 8.14172 numMergedOcc 0
32 mol 238 unq 6 iso 0 dist 8.69104 7.57812 6.25098 5.11565 6.62002 8.90076 10.7456 7.95232 10.4017 6.77463 numMergedOcc 0
33 mol 238 unq 7 iso 0 dist 8.69104 7.57812 6.25098 13.171 6.73446 8.09718 13.9668 5.50308 10.7081 6.05141 numMergedOcc 0
34 mol 238 unq 8 iso 0 dist 8.69104 7.57812 6.25098 13.171 6.73446 8.09718 12.8275 7.11984 12.2874 8.09066 numMergedOcc 0
35 mol 238 unq 9 iso 0 dist 8.69104 7.57812 6.25098 13.171 6.73446 8.09718 10.7456 7.95232 10.4017 7.2766 numMergedOcc 0
