0 mol 13 unq 0 iso 0 dist 9.22659 6.76336 9.37413 6.74124 8.00865 10.8881 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.11402 11.4929 8.62693 12.8104 9.25649 17.6797 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.11402 11.4929 8.62693 10.8584 9.36104 13.889 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.60482 6.50138 5.67098 5.92019 5.86571 7.39536 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 7.60482 10.8611 8.58218 5.92019 5.86571 11.4735 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 5.42653 7.17147 9.30724 10.7366 7.54496 13.8613 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 8.71991 13.7205 9.30724 7.4595 7.54496 13.8613 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.87854 13.3215 8.95838 7.79265 9.05798 7.58689 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 9.87854 13.3215 8.95838 11.822 5.85818 5.47002 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 9.87854 6.17994 9.47892 7.79265 9.05798 9.21153 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 9.87854 6.17994 9.47892 11.822 5.85818 13.8865 numMergedOcc 0
11 mol 146 unq 0 iso 0 dist 8.48719 9.27614 9.77771 5.43323 8.68349 13.2483 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 9.41487 7.45223 8.91189 7.80555 7.13269 6.23157 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 9.69154 9.71601 8.32685 7.56779 9.71865 6.35266 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 9.69154 13.0921 6.74777 7.56779 9.71865 10.3477 numMergedOcc 0
15 mol 197 unq 2 iso 0 dist 9.69154 17.3782 9.62514 7.56779 9.71865 13.7046 numMergedOcc 0
16 mol 197 unq 3 iso 0 dist 9.49122 15.0474 8.32685 12.7747 9.71865 6.35266 numMergedOcc 0
17 mol 197 unq 4 iso 0 dist 9.49122 13.8252 6.74777 12.7747 9.71865 10.3477 numMergedOcc 0
18 mol 197 unq 5 iso 0 dist 9.49122 14.2846 9.62514 12.7747 9.71865 13.7046 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 6.54661 5.22428 9.94175 6.12311 8.6597 11.1472 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 6.54661 11.6082 8.81534 6.12311 8.6597 13.5907 numMergedOcc 0
21 mol 248 unq 0 iso 0 dist 9.59898 8.43114 8.97536 9.43318 8.42446 5.82647 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 7.05438 4.80326 8.56029 5.37654 9.80746 10.046 numMergedOcc 0
23 mol 278 unq 1 iso 0 dist 7.08899 10.9341 8.56029 14.615 9.80746 10.046 numMergedOcc 0
24 mol 285 unq 0 iso 0 dist 5.32578 12.5795 8.85005 9.11674 5.80415 3.60708 numMergedOcc 0
25 mol 285 unq 1 iso 0 dist 5.32578 6.61129 8.96754 9.11674 5.80415 12.0894 numMergedOcc 0
