0 mol 1 unq 0 iso 0 dist 9.35554 5.99543 9.00903 6.04659 5.27206 8.27735 4.61559 12.2079 6.35409 8.40848 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 7.96299 6.75623 5.83409 5.89962 4.53359 6.31203 4.5896 7.75811 4.8042 4.90079 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 9.70016 13.2553 5.86073 17.0906 7.77295 8.29529 16.5593 10.783 14.0364 8.28452 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 9.94179 6.75154 6.5107 13.6997 4.32516 9.05674 11.088 9.3894 4.84607 9.86691 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.66715 14.0905 7.11802 9.94882 8.76089 8.94909 9.99937 12.969 14.4095 5.59311 numMergedOcc 0
5 mol 133 unq 2 iso 0 dist 8.66715 14.0905 7.11802 9.94882 8.76089 8.94909 13.0612 16.8036 17.145 9.22456 numMergedOcc 0
6 mol 133 unq 3 iso 0 dist 8.66715 14.0905 7.11802 9.94882 8.76089 8.94909 13.3005 9.50322 5.37072 5.7232 numMergedOcc 0
7 mol 133 unq 4 iso 0 dist 9.00172 14.0905 8.00618 9.94882 6.80087 8.94909 9.99937 9.84918 14.4095 5.59311 numMergedOcc 0
8 mol 133 unq 5 iso 0 dist 9.00172 14.0905 8.00618 9.94882 6.80087 8.94909 13.0612 11.3707 17.145 9.22456 numMergedOcc 0
9 mol 133 unq 6 iso 0 dist 9.00172 14.0905 8.00618 9.94882 6.80087 8.94909 13.3005 5.82404 5.37072 5.7232 numMergedOcc 0
10 mol 133 unq 7 iso 0 dist 8.95433 11.0811 7.11802 17.0842 8.76089 8.94909 21.4409 12.969 14.4095 5.59311 numMergedOcc 0
11 mol 133 unq 8 iso 0 dist 8.95433 11.0811 7.11802 17.0842 8.76089 8.94909 24.5595 16.8036 17.145 9.22456 numMergedOcc 0
12 mol 133 unq 9 iso 0 dist 8.95433 11.0811 7.11802 17.0842 8.76089 8.94909 15.4773 9.50322 5.37072 5.7232 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 9.79271 4.07683 9.62191 10.7584 4.76275 8.69629 9.31621 9.99314 6.70722 8.36119 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 8.95071 12.8358 6.27581 10.7065 5.03598 5.99137 9.48296 5.66569 4.15973 4.43243 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 8.95071 12.8358 6.27581 10.7065 5.03598 5.99137 5.05085 6.11137 9.01197 5.92025 numMergedOcc 0
16 mol 236 unq 2 iso 0 dist 8.95071 12.8358 6.27581 10.7065 5.03598 5.99137 12.3697 12.6124 14.6016 9.04819 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.82778 11.4665 6.16342 10.8536 9.00069 6.92721 17.5351 13.2218 9.86326 6.84088 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 8.23536 5.50714 7.4631 13.2013 10.2076 8.18588 9.23513 9.10633 7.20238 7.79013 numMergedOcc 0
19 mol 241 unq 1 iso 0 dist 6.90245 5.3674 7.4631 4.80928 10.2076 8.18588 3.92006 9.10633 7.20238 7.79013 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.65233 7.78423 9.17653 10.3741 5.7052 9.00498 14.0565 11.7413 7.46632 8.73749 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 8.49415 4.05162 8.4218 5.67503 4.75685 6.78702 8.73438 9.772 5.75478 8.09021 numMergedOcc 0
22 mol 265 unq 1 iso 0 dist 8.49415 4.05162 8.4218 8.35562 11.5105 8.59825 8.73438 9.772 5.75478 6.98451 numMergedOcc 0
