0 mol 7 unq 0 iso 0 dist 7.32392 10.4879 9.85726 15.5277 9.60499 11.5784 19.9982 13.823 13.4186 8.23909 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.32392 10.4879 9.85726 15.5277 9.60499 11.5784 11.5036 5.38502 12.8174 6.72215 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 6.89209 6.09608 8.39221 5.49061 6.38364 7.00835 11.6708 9.18933 7.54797 8.73627 numMergedOcc 0
3 mol 102 unq 0 iso 0 dist 9.84673 12.6508 9.10229 5.09542 7.36792 8.17186 7.73836 6.42572 14.2643 9.01767 numMergedOcc 0
4 mol 102 unq 1 iso 0 dist 9.84673 12.6508 9.10229 5.09542 7.36792 8.17186 10.8539 5.54551 10.1221 9.80678 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 7.0318 10.7285 7.70533 5.21051 7.90328 14.3476 8.30003 10.4589 12.9519 9.85576 numMergedOcc 0
6 mol 126 unq 0 iso 0 dist 6.24392 5.28929 9.06961 5.50061 6.06638 9.07346 9.40608 7.01529 14.0431 9.54928 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 7.98018 5.21836 9.16591 4.68187 9.83699 9.27577 11.5769 12.865 15.865 7.30021 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 6.21273 9.98645 7.31105 5.1021 9.23153 14.6296 8.58709 4.90657 9.58724 9.8711 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 9.73411 13.9782 9.33771 14.1073 8.95269 5.41021 18.7994 14.2632 5.90784 6.56437 numMergedOcc 0
10 mol 224 unq 1 iso 0 dist 9.73411 13.9782 9.33771 14.1073 8.95269 5.41021 19.6107 15.0038 9.97504 6.23882 numMergedOcc 0
11 mol 224 unq 2 iso 0 dist 9.73411 13.9782 9.33771 14.1073 8.95269 5.41021 18.4968 9.59595 8.50322 9.53131 numMergedOcc 0
12 mol 224 unq 3 iso 0 dist 9.73411 13.9782 9.33771 14.1073 8.95269 5.41021 15.0577 5.63485 11.1636 9.34636 numMergedOcc 0
13 mol 224 unq 4 iso 0 dist 9.73411 13.9782 9.33771 9.81806 6.57273 4.91322 15.0577 5.63485 11.1636 9.79616 numMergedOcc 0
14 mol 224 unq 5 iso 0 dist 9.73411 13.9782 9.33771 5.99647 5.78342 12.979 13.2758 4.8786 12.5889 9.29703 numMergedOcc 0
15 mol 224 unq 6 iso 0 dist 7.07564 14.788 9.33771 11.8217 8.95269 5.41021 18.3068 14.2632 5.90784 6.56437 numMergedOcc 0
16 mol 224 unq 7 iso 0 dist 7.07564 14.788 9.33771 11.8217 8.95269 5.41021 16.4902 15.0038 9.97504 6.23882 numMergedOcc 0
17 mol 224 unq 8 iso 0 dist 7.07564 14.788 9.33771 11.8217 8.95269 5.41021 14.6367 9.59595 8.50322 9.53131 numMergedOcc 0
18 mol 224 unq 9 iso 0 dist 7.07564 14.788 9.33771 11.8217 8.95269 5.41021 7.7163 5.63485 11.1636 9.34636 numMergedOcc 0
19 mol 224 unq 10 iso 0 dist 7.07564 14.788 9.33771 10.8463 6.57273 4.91322 7.7163 5.63485 11.1636 9.79616 numMergedOcc 0
20 mol 224 unq 11 iso 0 dist 7.07564 14.788 9.33771 5.44863 5.78342 12.979 9.2 4.8786 12.5889 9.29703 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 5.62804 5.24985 8.49299 6.33989 6.7547 6.9602 5.00735 7.07028 10.1534 8.43766 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.06422 7.10888 6.83152 5.33697 6.57393 10.8336 14.9437 13.477 18.6237 9.75174 numMergedOcc 0
