0 mol 7 unq 0 iso 0 dist 5.83658 10.826 9.60499 15.6742 15.5277 7.32392 10.7603 13.7966 8.54694 9.58865 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 6.30573 6.24146 9.04767 10.6355 10.3326 9.31271 17.2585 18.2908 16.5607 8.79533 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.46752 6.06561 5.46498 11.7065 5.46269 6.84569 10.3638 9.79958 6.43294 8.46837 numMergedOcc 0
3 mol 102 unq 0 iso 0 dist 9.0361 7.49575 7.36792 11.8703 5.09542 9.84673 11.7098 9.01767 6.42572 7.73836 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 6.09472 5.74878 4.99221 10.4328 5.24229 6.04412 9.42841 8.81562 5.71451 8.16113 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 8.93552 6.07331 4.99221 8.86521 5.24229 6.04412 10.887 8.81562 5.71451 8.16113 numMergedOcc 0
6 mol 115 unq 2 iso 0 dist 6.20658 7.09627 4.99221 9.95293 5.24229 6.04412 12.6008 8.81562 5.71451 8.16113 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 9.63302 6.06241 8.62381 9.67137 5.14495 6.03557 13.8016 14.6763 9.19339 9.64304 numMergedOcc 0
8 mol 222 unq 0 iso 0 dist 7.27481 5.68063 6.00706 6.19798 5.01062 8.7419 4.56782 8.7347 8.81265 7.10689 numMergedOcc 0
9 mol 222 unq 1 iso 0 dist 7.27481 5.90074 7.54212 6.19798 5.01062 8.5834 4.56782 8.7347 4.28891 7.10689 numMergedOcc 0
10 mol 224 unq 0 iso 0 dist 4.79841 11.4653 8.95269 18.4903 14.1073 9.73411 24.3809 20.6047 14.3302 8.68767 numMergedOcc 0
11 mol 224 unq 1 iso 0 dist 4.79841 11.4653 8.95269 14.1813 11.8217 7.07564 9.46589 9.34636 5.63485 7.7163 numMergedOcc 0
12 mol 224 unq 2 iso 0 dist 4.79841 11.4653 8.95269 14.1813 11.8217 7.07564 13.9521 12.8171 4.8786 9.2 numMergedOcc 0
13 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 18.4635 10.613 8.91036 22.2559 16.203 11.548 6.73226 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 7.80525 4.84708 7.32223 11.7612 9.23512 7.26981 13.671 14.8393 9.56248 9.35766 numMergedOcc 0
15 mol 253 unq 1 iso 0 dist 7.71295 4.84708 8.31064 11.7612 10.8952 7.26981 13.671 17.3894 9.56248 9.35766 numMergedOcc 0
16 mol 280 unq 0 iso 0 dist 9.26066 12.5899 6.53701 10.04 8.30978 8.80588 16.733 16.7212 14.1091 9.047 numMergedOcc 0
17 mol 280 unq 1 iso 0 dist 9.26066 12.5899 6.53701 10.04 8.30978 8.80588 15.4857 11.1402 4.95798 9.9227 numMergedOcc 0
