0 mol 70 unq 0 iso 0 dist 9.28709 9.2794 9.10017 4.67358 7.98177 10.1805 numMergedOcc 0
1 mol 128 unq 0 iso 0 dist 9.36937 5.32517 8.76554 9.23513 12.02 5.69884 numMergedOcc 0
2 mol 128 unq 1 iso 0 dist 9.36937 7.6275 6.56049 9.23513 12.02 6.06734 numMergedOcc 0
3 mol 128 unq 2 iso 0 dist 9.36937 7.4738 13.1723 9.23513 12.02 9.5501 numMergedOcc 0
4 mol 128 unq 3 iso 0 dist 9.36937 8.88867 7.4928 9.23513 12.02 13.9717 numMergedOcc 0
5 mol 128 unq 4 iso 0 dist 9.36937 7.04282 5.92897 9.23513 12.02 10.1474 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 9.17599 8.49649 13.5421 5.8367 11.473 4.02705 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.78704 8.49649 9.3059 5.8367 9.96852 4.02705 numMergedOcc 0
8 mol 146 unq 0 iso 0 dist 8.21621 6.98479 9.67898 7.498 5.43323 10.9118 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 5.7126 9.08229 13.3242 6.6276 8.6934 6.2621 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 5.7126 7.99057 10.1682 6.6276 8.6934 6.17537 numMergedOcc 0
11 mol 248 unq 0 iso 0 dist 8.2748 8.4908 8.43114 9.08064 10.7978 11.3225 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 9.03526 8.79625 17.6708 9.06043 5.37654 16.2355 numMergedOcc 0
13 mol 278 unq 1 iso 0 dist 9.03526 9.9609 4.91961 9.06043 5.37654 5.89139 numMergedOcc 0
14 mol 278 unq 2 iso 0 dist 8.03252 8.79625 13.4866 9.06043 14.615 16.2355 numMergedOcc 0
15 mol 278 unq 3 iso 0 dist 8.03252 9.9609 12.3196 9.06043 14.615 5.89139 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 6.2587 6.38338 7.88871 6.89742 7.38662 5.43917 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 6.2587 6.38338 7.88871 6.89742 7.38662 5.43917 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 6.2587 6.38338 7.88871 6.89742 7.38662 5.43917 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 8.01956 9.05047 10.846 9.65173 10.5255 7.79914 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 8.01956 7.24072 9.02523 9.65173 10.5255 4.49398 numMergedOcc 0
