0 mol 46 unq 0 iso 0 dist 9.27409 8.79378 6.67753 10.9654 13.5957 9.7691 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.91502 5.75135 10.4849 7.55848 11.1418 9.56859 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.4486 8.48827 4.35598 3.93133 10.079 8.03895 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.4486 7.14048 5.50339 3.93133 10.079 5.68873 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 5.59552 6.04223 6.882 12.0142 14.1545 7.29864 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 5.62309 7.29864 3.79182 12.0142 9.50373 6.04223 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 5.62309 7.7399 8.93569 6.46167 9.95946 5.48163 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 6.37888 5.48163 3.98877 6.46167 7.11438 7.7399 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 7.11438 7.29864 9.74373 12.0142 14.5757 6.04223 numMergedOcc 0
9 mol 92 unq 5 iso 0 dist 7.11438 7.7399 3.98877 6.46167 6.37888 5.48163 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.25249 9.68556 3.61204 4.66569 8.41411 8.73928 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 8.41411 8.73928 3.61204 4.66569 9.25249 9.68556 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 7.6005 8.24233 4.13755 9.4971 10.2858 8.50194 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 9.49761 8.46801 12.2606 9.43368 12.5952 5.38983 numMergedOcc 0
14 mol 128 unq 1 iso 0 dist 6.03154 8.46801 6.30769 9.43368 10.3883 5.38983 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 6.72323 8.52036 12.7291 10.5425 9.58772 8.22722 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 8.30496 9.48934 8.79381 9.03348 9.5805 6.41183 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 6.78469 9.48934 5.16197 9.03348 8.01453 6.41183 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 8.01453 6.41183 5.16197 9.03348 6.78469 9.48934 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 8.62191 8.29256 9.07662 3.78668 11.7905 8.49554 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 7.23557 8.93485 9.43113 4.20051 8.86587 5.66636 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 8.86587 5.66636 9.43113 4.20051 7.23557 8.93485 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 6.09838 8.61846 8.33563 10.8843 11.9822 8.77675 numMergedOcc 0
