0 mol 10 unq 0 iso 0 dist 8.33546 9.59744 8.12738 6.42677 8.19933 9.17574 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.33546 9.59744 8.12738 4.28255 10.9464 8.79953 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.97806 7.63824 7.33787 11.6096 13.0535 5.9372 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 9.97806 7.63824 7.33787 10.8208 13.5678 6.93597 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.32779 7.63824 5.43498 11.6096 10.3017 5.9372 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.32779 7.63824 5.43498 10.8208 9.05162 6.93597 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 8.38139 6.77802 5.7037 4.31769 10.1237 8.40186 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 8.38139 9.07283 3.42062 7.16993 8.16033 9.42099 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.52742 8.15861 7.14242 4.32784 10.6441 8.04853 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 7.52742 6.56288 3.81285 14.0998 12.1571 9.13593 numMergedOcc 0
10 mol 85 unq 2 iso 0 dist 7.52742 5.97559 6.17121 14.0998 12.1571 8.25144 numMergedOcc 0
11 mol 90 unq 0 iso 0 dist 9.93577 8.17454 10.526 12.0042 18.3796 8.61893 numMergedOcc 0
12 mol 90 unq 1 iso 0 dist 7.38568 6.02596 4.66066 9.64845 13.1963 8.61893 numMergedOcc 0
13 mol 90 unq 2 iso 0 dist 8.6767 8.17454 4.66066 12.0042 13.1963 8.61893 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 8.42914 7.09177 6.21311 5.75219 7.42828 9.97813 numMergedOcc 0
15 mol 91 unq 1 iso 0 dist 8.17327 7.09177 7.17072 5.75219 5.98441 9.97813 numMergedOcc 0
16 mol 91 unq 2 iso 0 dist 9.52936 7.09177 10.0233 5.75219 5.45873 9.97813 numMergedOcc 0
17 mol 93 unq 0 iso 0 dist 5.27541 5.96189 3.99275 6.45786 6.70158 7.48947 numMergedOcc 0
18 mol 93 unq 1 iso 0 dist 9.00874 8.92653 3.27874 6.87756 7.24843 5.56839 numMergedOcc 0
19 mol 93 unq 2 iso 0 dist 9.00874 8.92653 3.27874 5.82092 7.63783 7.83506 numMergedOcc 0
20 mol 111 unq 0 iso 0 dist 5.68841 6.33923 7.42165 12.6461 16.5492 9.72371 numMergedOcc 0
21 mol 124 unq 0 iso 0 dist 7.24083 8.06631 6.49874 4.31676 10.1598 8.65859 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 5.52744 7.00382 8.73397 5.48326 7.77211 8.2241 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 9.18565 9.05453 3.86368 14.815 6.67593 6.18742 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 5.06731 6.05363 3.76412 14.8133 12.182 9.23152 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 5.06731 6.05363 3.76412 14.8133 12.182 9.23152 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 5.06731 6.05363 3.76412 14.8133 12.182 9.23152 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 8.63523 8.65363 14.0395 9.08006 17.0197 9.01437 numMergedOcc 0
