0 mol 6 unq 0 iso 0 dist 8.8273 9.71239 9.88888 6.58426 8.36949 13.746 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.83168 9.6867 9.54812 13.0423 8.70005 16.7121 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 9.83168 5.13138 7.33943 13.0423 8.70005 13.8769 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.49909 9.01516 13.124 8.97054 8.37022 16.1336 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 7.86678 9.0907 10.0193 11.3476 9.27229 14.9826 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.53504 8.0534 10.565 13.6926 7.84699 11.5853 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.66342 8.0534 10.0209 13.6926 8.40844 11.5853 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.66342 8.0534 10.0209 12.3241 7.02351 13.6282 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 7.21285 8.0534 6.28525 13.6926 6.99156 11.5853 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 9.29934 9.39011 6.94693 5.19555 6.7293 10.6324 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 3.59451 8.70888 11.7752 5.4823 6.2491 11.2355 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 8.6728 9.67735 7.44829 11.7765 7.26246 11.068 numMergedOcc 0
12 mol 193 unq 0 iso 0 dist 5.19654 7.46207 7.98055 13.1729 9.16852 16.2465 numMergedOcc 0
13 mol 193 unq 1 iso 0 dist 5.19654 7.46207 7.98055 8.96814 8.6538 15.3491 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 7.757 9.9518 9.44664 6.11542 9.56015 11.7733 numMergedOcc 0
15 mol 211 unq 0 iso 0 dist 9.45365 9.36408 7.63577 4.78922 7.15386 10.6827 numMergedOcc 0
16 mol 211 unq 1 iso 0 dist 9.45365 9.36408 7.63577 8.05917 7.73993 10.5687 numMergedOcc 0
17 mol 211 unq 2 iso 0 dist 5.42004 8.80139 10.9253 5.16245 9.63472 11.1787 numMergedOcc 0
18 mol 211 unq 3 iso 0 dist 5.42004 8.80139 10.9253 9.68345 9.63103 18.394 numMergedOcc 0
19 mol 211 unq 4 iso 0 dist 7.73993 8.80139 6.37019 5.16245 7.15386 11.1787 numMergedOcc 0
20 mol 211 unq 5 iso 0 dist 7.73993 8.80139 6.37019 8.05917 9.45365 14.4597 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 8.75468 9.61475 12.2857 9.83283 7.80496 17.7496 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 8.75468 9.61475 12.2857 7.23892 8.60479 9.68034 numMergedOcc 0
23 mol 220 unq 2 iso 0 dist 8.60479 9.68034 12.2857 11.1254 7.80496 17.7496 numMergedOcc 0
24 mol 220 unq 3 iso 0 dist 8.60479 9.68034 12.2857 7.23892 8.75468 9.61475 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 7.24089 8.9766 12.8903 7.42692 9.29005 15.4608 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 7.88102 7.84195 15.0876 11.2306 5.25218 17.8991 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 7.88102 7.84195 15.0876 10.2609 8.31465 15.2366 numMergedOcc 0
28 mol 281 unq 0 iso 0 dist 9.61122 8.92291 8.43368 4.37277 9.95684 11.5178 numMergedOcc 0
