0 mol 2 unq 0 iso 0 dist 7.99162 6.38677 9.58976 13.4315 9.97525 9.08872 5.59831 6.35342 6.23988 9.74371 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 7.99162 6.38677 9.58976 9.9335 11.2776 7.37296 10.8368 15.0494 6.80804 6.15195 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 7.99162 5.59831 6.35342 13.4315 9.97525 9.74371 6.38677 9.58976 6.23988 9.08872 numMergedOcc 0
3 mol 4 unq 0 iso 0 dist 8.66947 6.80703 9.71908 6.22303 6.8787 9.84876 5.13908 13.0418 11.2643 8.7041 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.72872 10.3388 5.38191 12.3331 6.33921 5.44539 13.8573 9.87592 4.57786 8.13653 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 5.50504 5.25196 9.62468 7.96502 6.32949 8.30431 6.97911 5.92705 8.0979 4.628 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 5.50504 6.97911 5.92705 7.96502 6.32949 4.628 5.25196 9.62468 8.0979 8.30431 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.8079 11.4622 4.98104 14.3988 5.1767 8.67865 21.0107 12.9107 14.4981 9.56884 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 9.8079 11.4622 4.98104 14.3988 5.1767 8.67865 20.1043 10.7379 10.1168 8.40148 numMergedOcc 0
9 mol 92 unq 2 iso 0 dist 8.3558 5.38868 4.98104 8.98532 5.1767 8.67865 12.3568 12.9107 14.4981 9.56884 numMergedOcc 0
10 mol 92 unq 3 iso 0 dist 8.3558 5.38868 4.98104 8.98532 5.1767 8.67865 5.80362 10.7379 10.1168 8.40148 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 8.84131 10.8385 9.10229 6.7095 7.49575 5.43401 13.457 12.8661 3.9342 8.63522 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 6.99793 5.67441 7.25166 6.15949 7.65733 5.31281 10.0602 12.8848 5.67339 8.9922 numMergedOcc 0
13 mol 114 unq 1 iso 0 dist 6.71345 5.67441 8.42445 6.15949 5.24877 5.31281 10.0602 10.2889 5.67339 8.9922 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 8.04723 6.1397 8.0974 9.3355 13.6129 8.14441 5.50567 12.1615 5.82281 6.25455 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 7.70631 16.2482 8.64255 13.2088 8.58314 8.51118 16.2517 10.499 7.28269 6.5 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 5.82039 10.3181 8.31638 12.0866 7.20088 7.65323 13.5193 10.1373 7.34999 4.51269 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 5.82039 8.09615 9.72979 13.9226 12.1408 8.63033 15.0906 15.8867 7.07077 8.02214 numMergedOcc 0
18 mol 206 unq 2 iso 0 dist 6.22964 8.09615 6.97859 13.9226 9.19627 8.63033 15.0906 12.2199 7.07077 8.02214 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 8.58471 15.9233 9.67457 17.8352 13.3929 6.24111 10.3382 9.90494 9.07869 8.60412 numMergedOcc 0
20 mol 210 unq 1 iso 0 dist 8.58471 15.9233 9.67457 15.2952 12.3088 9.00343 10.3382 9.90494 9.07869 7.05535 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 8.14644 14.5536 7.31105 10.4705 6.19375 7.57712 15.0227 10.2676 5.88344 7.20255 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 9.82717 14.401 8.71213 11.6641 5.93692 4.74716 15.8124 13.8061 6.55738 8.63954 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 8.33653 8.64319 8.71213 8.17214 5.93692 4.74716 14.6688 13.8061 6.55738 8.63954 numMergedOcc 0
24 mol 285 unq 2 iso 0 dist 6.44657 14.1417 8.71213 11.464 5.93692 4.74716 19.8303 13.8061 6.55738 8.63954 numMergedOcc 0
