0 mol 5 unq 0 iso 0 dist 8.72524 4.47188 4.98321 10.4923 4.21127 7.95876 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.49404 4.80814 7.77964 10.6557 4.79736 8.09311 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.61802 9.79566 7.01952 11.1344 4.55481 7.18022 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.61802 8.89606 4.58552 11.1344 4.55481 6.24711 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 6.86162 4.55988 8.77529 11.8011 9.96534 9.03564 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 5.14123 6.13703 8.66724 6.47132 6.08003 6.56212 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.05057 6.70451 9.79643 12.9219 7.63763 9.11586 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.25027 5.815 7.48208 11.7225 6.9945 8.26547 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 8.25027 5.815 7.48208 9.45717 4.19723 9.05342 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 9.11877 12.9512 9.29944 11.9411 4.78563 5.40637 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 5.65314 4.26432 6.69042 7.18765 9.61454 9.10817 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 5.65314 4.26432 6.69042 7.41091 7.59871 6.86828 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 6.3407 9.68207 5.03818 14.9664 8.97813 6.49765 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 8.91548 4.10207 9.95026 6.18991 5.14674 9.21377 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 8.38459 7.14533 7.90657 9.24466 4.72944 7.94911 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 9.48525 4.57447 6.46405 11.8089 6.28241 8.14831 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 7.42359 9.70906 8.20943 10.1236 5.71505 7.10671 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.20902 14.6762 7.16209 18.2066 11.2997 9.57499 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.20902 14.6762 7.16209 12.4435 4.40029 5.46926 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 8.20902 14.6762 7.16209 6.86014 3.97543 8.9682 numMergedOcc 0
20 mol 277 unq 3 iso 0 dist 8.20902 11.68 4.62936 12.4435 4.40029 5.13913 numMergedOcc 0
21 mol 277 unq 4 iso 0 dist 8.20902 11.68 4.62936 6.86014 3.97543 6.92711 numMergedOcc 0
22 mol 277 unq 5 iso 0 dist 7.98589 6.40883 7.16209 10.0577 11.2997 9.57499 numMergedOcc 0
23 mol 277 unq 6 iso 0 dist 7.98589 6.40883 7.16209 8.23147 4.40029 5.46926 numMergedOcc 0
24 mol 277 unq 7 iso 0 dist 7.98589 6.40883 7.16209 6.49176 3.97543 8.9682 numMergedOcc 0
25 mol 277 unq 8 iso 0 dist 7.98589 6.79352 4.62936 8.23147 4.40029 5.13913 numMergedOcc 0
26 mol 277 unq 9 iso 0 dist 7.98589 6.79352 4.62936 6.49176 3.97543 6.92711 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 8.51266 6.03672 7.89938 6.02089 6.73772 9.9886 numMergedOcc 0
