0 mol 2 unq 0 iso 0 dist 9.9335 6.38677 7.37296 10.8368 6.15195 6.80804 7.99162 11.2776 9.58976 15.0494 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.9335 6.38677 7.37296 10.8368 6.15195 6.80804 15.1169 11.0228 9.57645 12.1029 numMergedOcc 0
2 mol 4 unq 0 iso 0 dist 6.22303 6.80703 9.84876 5.13908 8.7041 11.2643 8.66947 6.8787 9.71908 13.0418 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.96502 5.25196 8.30431 6.97911 4.628 8.0979 5.50504 6.32949 9.62468 5.92705 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 7.96502 6.97911 4.628 5.25196 8.30431 8.0979 5.50504 6.32949 5.92705 9.62468 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.98532 5.38868 8.67865 12.3568 9.56884 14.4981 8.3558 5.1767 4.98104 12.9107 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 8.98532 5.38868 8.67865 5.80362 8.40148 10.1168 8.3558 5.1767 4.98104 10.7379 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 6.7095 10.8385 5.43401 13.457 8.63522 3.9342 8.84131 7.49575 9.10229 12.8661 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 6.15949 5.67441 5.31281 10.0602 8.9922 5.67339 6.99793 7.65733 7.25166 12.8848 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 6.15949 5.67441 5.31281 10.0602 8.9922 5.67339 6.71345 5.24877 8.42445 10.2889 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 7.47105 10.6706 7.50126 5.33627 5.12189 11.0817 16.0647 15.9524 8.84018 18.3258 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 9.3355 6.1397 8.14441 5.50567 6.25455 5.82281 8.04723 13.6129 8.0974 12.1615 numMergedOcc 0
12 mol 199 unq 0 iso 0 dist 7.22303 5.56055 9.88917 10.5991 9.56785 10.3162 12.3026 11.2655 8.68505 12.7467 numMergedOcc 0
13 mol 199 unq 1 iso 0 dist 7.22303 10.5991 9.56785 5.56055 9.88917 10.3162 11.9981 5.60906 9.60407 12.6059 numMergedOcc 0
14 mol 284 unq 0 iso 0 dist 9.70969 10.1709 8.60951 9.73593 9.1882 7.36026 13.3241 4.59796 8.10742 10.6254 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 8.17214 8.64319 4.74716 14.6688 8.63954 6.55738 8.33653 5.93692 8.71213 13.8061 numMergedOcc 0
