0 mol 27 unq 0 iso 0 dist 6.68662 11.3613 9.11084 4.66619 9.76721 10.6589 14.2179 9.21168 12.214 17.257 numMergedOcc 0
1 mol 27 unq 0 iso 1 dist 9.11084 11.3613 6.68662 10.6589 9.76721 4.66619 12.214 9.21168 14.2179 17.257 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 8.44721 5.55889 5.31062 10.585 9.71891 9.21621 6.54204 6.24688 4.66466 4.68435 numMergedOcc 0
3 mol 44 unq 0 iso 1 dist 5.31062 5.55889 8.44721 9.21621 9.71891 10.585 4.66466 6.24688 6.54204 4.68435 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 8.44721 5.55889 5.31062 5.57404 7.55822 7.08048 6.54204 6.24688 4.66466 4.0144 numMergedOcc 0
5 mol 44 unq 1 iso 1 dist 5.31062 5.55889 8.44721 7.08048 7.55822 5.57404 4.66466 6.24688 6.54204 4.0144 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 9.38103 12.2267 6.13256 7.2983 6.00709 11.0627 12.644 6.32539 7.75261 7.47787 numMergedOcc 0
7 mol 54 unq 0 iso 1 dist 6.13256 12.2267 9.38103 11.0627 6.00709 7.2983 7.75261 6.32539 12.644 7.47787 numMergedOcc 0
8 mol 151 unq 0 iso 0 dist 5.37884 4.43638 6.24917 4.51635 8.13302 8.56008 8.34293 9.62391 7.90899 12.2326 numMergedOcc 0
9 mol 151 unq 0 iso 1 dist 6.24917 4.43638 5.37884 8.56008 8.13302 4.51635 7.90899 9.62391 8.34293 12.2326 numMergedOcc 0
10 mol 151 unq 1 iso 0 dist 5.37884 4.43638 6.24917 5.24414 5.11555 5.34678 8.34293 9.62391 7.90899 12.2132 numMergedOcc 0
11 mol 151 unq 1 iso 1 dist 6.24917 4.43638 5.37884 5.34678 5.11555 5.24414 7.90899 9.62391 8.34293 12.2132 numMergedOcc 0
12 mol 151 unq 2 iso 0 dist 5.37884 4.43638 6.24917 7.9137 8.29457 4.83603 8.34293 9.62391 7.90899 5.14768 numMergedOcc 0
13 mol 151 unq 2 iso 1 dist 6.24917 4.43638 5.37884 4.83603 8.29457 7.9137 7.90899 9.62391 8.34293 5.14768 numMergedOcc 0
14 mol 276 unq 0 iso 0 dist 8.34851 15.7389 9.97781 12.7549 6.11207 4.67753 13.3593 8.18835 7.98696 4.54046 numMergedOcc 0
15 mol 276 unq 0 iso 1 dist 9.97781 15.7389 8.34851 4.67753 6.11207 12.7549 7.98696 8.18835 13.3593 4.54046 numMergedOcc 0
16 mol 276 unq 1 iso 0 dist 8.34851 15.7389 9.97781 12.7549 6.11207 4.67753 12.6143 9.35239 4.6881 6.22177 numMergedOcc 0
17 mol 276 unq 1 iso 1 dist 9.97781 15.7389 8.34851 4.67753 6.11207 12.7549 4.6881 9.35239 12.6143 6.22177 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.34771 4.80485 9.40332 9.63141 7.81415 10.2512 7.04495 4.1631 9.44903 4.01355 numMergedOcc 0
19 mol 283 unq 0 iso 1 dist 9.40332 4.80485 5.34771 10.2512 7.81415 9.63141 9.44903 4.1631 7.04495 4.01355 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 6.57496 3.96857 7.9554 7.22566 9.96295 5.71244 13.5901 9.91859 14.2485 11.4826 numMergedOcc 0
21 mol 286 unq 0 iso 1 dist 7.9554 3.96857 6.57496 5.71244 9.96295 7.22566 14.2485 9.91859 13.5901 11.4826 numMergedOcc 0
22 mol 286 unq 1 iso 0 dist 6.57496 3.96857 7.9554 5.79125 8.95266 9.73618 13.5901 9.91859 14.2485 14.9051 numMergedOcc 0
23 mol 286 unq 1 iso 1 dist 7.9554 3.96857 6.57496 9.73618 8.95266 5.79125 14.2485 9.91859 13.5901 14.9051 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.86603 12.8716 7.17626 11.5428 6.08044 5.60788 17.4205 9.82863 6.64598 8.76196 numMergedOcc 0
25 mol 287 unq 0 iso 1 dist 7.17626 12.8716 7.86603 5.60788 6.08044 11.5428 6.64598 9.82863 17.4205 8.76196 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 7.86603 12.8716 7.17626 14.8583 8.8956 10.718 17.4205 9.82863 6.64598 10.0477 numMergedOcc 0
27 mol 287 unq 1 iso 1 dist 7.17626 12.8716 7.86603 10.718 8.8956 14.8583 6.64598 9.82863 17.4205 10.0477 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.86603 12.8716 7.17626 11.5428 6.08044 5.60788 17.4205 9.82863 6.64598 8.76196 numMergedOcc 0
29 mol 288 unq 0 iso 1 dist 7.17626 12.8716 7.86603 5.60788 6.08044 11.5428 6.64598 9.82863 17.4205 8.76196 numMergedOcc 0
30 mol 288 unq 1 iso 0 dist 7.86603 12.8716 7.17626 14.8583 8.8956 10.718 17.4205 9.82863 6.64598 10.0477 numMergedOcc 0
31 mol 288 unq 1 iso 1 dist 7.17626 12.8716 7.86603 10.718 8.8956 14.8583 6.64598 9.82863 17.4205 10.0477 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.86603 12.8716 7.17626 11.5428 6.08044 5.60788 17.4205 9.82863 6.64598 8.76196 numMergedOcc 0
33 mol 289 unq 0 iso 1 dist 7.17626 12.8716 7.86603 5.60788 6.08044 11.5428 6.64598 9.82863 17.4205 8.76196 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.86603 12.8716 7.17626 14.8583 8.8956 10.718 17.4205 9.82863 6.64598 10.0477 numMergedOcc 0
35 mol 289 unq 1 iso 1 dist 7.17626 12.8716 7.86603 10.718 8.8956 14.8583 6.64598 9.82863 17.4205 10.0477 numMergedOcc 0
