0 mol 16 unq 0 iso 0 dist 7.65729 9.93633 9.51574 5.39064 6.29703 5.58451 8.4361 5.64581 8.86163 4.86568 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.72142 10.1908 9.51574 5.40044 8.47315 11.0043 6.28033 5.59769 12.359 4.7319 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 7.72142 4.49982 9.39137 5.40044 8.47315 6.73304 6.28033 5.59769 9.29952 4.7319 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 6.17472 5.22602 9.52614 5.3372 6.87871 10.4854 13.0456 8.95909 17.7419 9.24927 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 4.96897 4.8012 8.62884 6.96065 5.83937 10.6998 9.92844 6.62193 14.5278 6.65595 numMergedOcc 0
5 mol 60 unq 1 iso 0 dist 4.96897 4.8012 8.62884 6.96065 5.83937 10.6998 14.2472 10.9885 18.7986 9.25011 numMergedOcc 0
6 mol 60 unq 2 iso 0 dist 4.96897 4.8012 8.62884 6.96065 5.83937 10.6998 12.177 9.96073 14.5138 6.43294 numMergedOcc 0
7 mol 60 unq 3 iso 0 dist 4.96897 4.8012 8.62884 6.96065 5.83937 10.6998 14.7815 11.2445 18.1507 8.52121 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 8.26291 10.0626 6.00391 10.9365 7.83619 11.8666 13.2314 10.0837 16.086 9.28393 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 8.26291 8.28869 9.70695 10.9365 7.83619 5.15286 13.2314 10.0837 10.2741 9.28393 numMergedOcc 0
10 mol 130 unq 2 iso 0 dist 7.86001 9.84637 6.00391 5.63567 7.83619 11.8666 12.6804 10.0837 16.086 9.28393 numMergedOcc 0
11 mol 130 unq 3 iso 0 dist 7.86001 10.3345 9.70695 5.63567 7.83619 5.15286 12.6804 10.0837 10.2741 9.28393 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 8.79185 6.56752 8.24004 5.59399 6.71202 4.08699 7.11647 5.70205 10.543 7.66148 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 5.69733 8.11142 9.03521 5.68711 8.49704 13.0236 13.6328 12.4611 18.3354 9.65138 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 5.69733 8.11142 9.03521 5.68711 8.49704 13.0236 11.6154 11.832 19.1405 7.14453 numMergedOcc 0
15 mol 214 unq 2 iso 0 dist 5.69733 8.11142 9.03521 5.68711 8.49704 13.0236 11.5105 10.644 14.746 8.85478 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.58709 9.98645 9.58724 5.1021 9.8711 14.6296 6.21273 4.90657 7.31105 9.23153 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 4.3362 9.61081 9.58724 9.20027 7.31105 4.90657 17.1012 14.6296 9.8711 9.23153 numMergedOcc 0
18 mol 220 unq 2 iso 0 dist 4.3362 9.61081 9.58724 9.20027 7.31105 4.90657 13.6374 9.52692 12.6756 8.24498 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 7.46044 10.2723 8.23071 13.1803 9.75313 10.9485 10.6043 6.46679 12.5309 6.61986 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 4.99301 6.27118 5.90784 5.25583 6.56437 5.41021 13.0296 14.2632 9.33771 8.95269 numMergedOcc 0
21 mol 248 unq 0 iso 0 dist 7.83878 5.42089 9.39764 5.68749 7.66519 6.12544 12.7933 6.42363 12.4697 9.56569 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.16791 6.30893 6.13752 12.4673 6.77279 6.59107 14.3065 7.55268 9.74679 8.53687 numMergedOcc 0
23 mol 259 unq 1 iso 0 dist 9.16791 6.30893 6.13752 12.4673 6.77279 6.59107 13.8844 5.71237 10.8647 8.13497 numMergedOcc 0
24 mol 259 unq 2 iso 0 dist 9.16791 6.30893 6.13752 16.6792 9.58006 11.1778 13.8844 5.71237 10.8647 7.88519 numMergedOcc 0
25 mol 259 unq 3 iso 0 dist 9.16791 6.30893 6.13752 16.6792 9.58006 11.1778 18.1068 9.10984 14.2398 7.84554 numMergedOcc 0
26 mol 259 unq 4 iso 0 dist 9.16791 6.30893 6.13752 16.6792 9.58006 11.1778 18.6945 11.8501 15.0974 7.46176 numMergedOcc 0
27 mol 259 unq 5 iso 0 dist 9.16791 6.30893 6.13752 16.6792 9.58006 11.1778 22.9986 13.9868 18.1936 9.18903 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 8.66917 5.4751 9.77593 5.31331 8.13489 10.2086 12.6214 5.51096 14.659 9.70696 numMergedOcc 0
