0 mol 7 unq 0 iso 0 dist 8.41585 9.68596 14.7759 13.5229 7.78327 16.2245 5.03847 10.3148 6.14469 12.3896 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.97507 7.48342 12.1303 6.49982 8.28153 12.9387 4.29582 11.7302 6.03257 8.82198 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 4.51865 8.40416 7.08342 4.44441 7.7312 12.7679 4.64838 6.41423 9.95212 5.31883 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 6.864 7.75618 7.08342 10.0411 7.7312 12.7679 4.97119 6.41423 9.95212 5.31883 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.86014 9.41441 6.66749 8.66248 7.49157 11.4816 4.32034 7.33768 8.00171 7.02381 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.86014 9.41441 6.66749 8.66248 7.49157 11.4816 12.2662 12.2059 5.95834 15.7269 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 6.86014 9.41441 6.66749 8.66248 7.49157 11.4816 8.67951 9.01567 4.2121 13.4969 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 6.86014 9.41441 6.66749 8.66248 7.49157 11.4816 8.52463 7.29868 6.72323 14.1137 numMergedOcc 0
8 mol 24 unq 4 iso 0 dist 6.86014 9.41441 6.66749 6.73521 7.73794 12.7944 4.32034 7.33768 8.00171 7.18485 numMergedOcc 0
9 mol 24 unq 5 iso 0 dist 6.86014 9.41441 6.66749 6.73521 7.73794 12.7944 12.2662 12.2059 5.95834 16.927 numMergedOcc 0
10 mol 24 unq 6 iso 0 dist 6.86014 9.41441 6.66749 6.73521 7.73794 12.7944 8.67951 9.01567 4.2121 13.9252 numMergedOcc 0
11 mol 24 unq 7 iso 0 dist 6.86014 9.41441 6.66749 6.73521 7.73794 12.7944 8.52463 7.29868 6.72323 13.4584 numMergedOcc 0
12 mol 24 unq 8 iso 0 dist 5.54419 8.4051 5.11617 6.7846 8.23075 7.85986 12.176 6.73939 6.72323 12.2839 numMergedOcc 0
13 mol 24 unq 9 iso 0 dist 5.54419 8.4051 5.11617 8.03955 4.7841 4.30252 12.176 6.73939 6.72323 6.22954 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 8.70481 9.24757 15.3808 15.1432 7.37171 22.417 6.29906 10.8139 8.87464 17.9675 numMergedOcc 0
15 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 8.29813 7.92856 13.6994 7.94178 11.3043 7.36769 14.0839 numMergedOcc 0
16 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 8.29813 7.92856 13.6994 4.4057 6.65501 6.88901 11.6496 numMergedOcc 0
17 mol 98 unq 2 iso 0 dist 6.10456 4.47349 7.06961 12.7473 7.92856 13.6994 9.85543 11.3043 7.36769 14.0839 numMergedOcc 0
18 mol 98 unq 3 iso 0 dist 6.10456 4.47349 7.06961 12.7473 7.92856 13.6994 9.67482 6.65501 6.88901 11.6496 numMergedOcc 0
19 mol 113 unq 0 iso 0 dist 5.86073 8.8822 10.1816 13.0914 9.59585 9.34113 7.27193 11.9334 6.6317 14.7833 numMergedOcc 0
20 mol 113 unq 1 iso 0 dist 5.86073 8.8822 10.1816 12.5818 9.7073 14.2952 7.27193 11.9334 6.6317 15.9735 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 7.63312 5.9176 5.63555 13.2274 8.29467 12.0951 6.29863 11.9764 7.22883 18.1133 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 4.04428 8.25985 9.78273 12.5452 13.7227 9.78181 12.3206 numMergedOcc 0
23 mol 232 unq 1 iso 0 dist 8.27212 9.40808 4.9377 4.04428 8.25985 9.78273 8.80479 9.05071 9.8664 12.159 numMergedOcc 0
24 mol 232 unq 2 iso 0 dist 8.27212 9.40808 4.9377 4.22149 9.27788 11.9664 12.5452 13.7227 9.78181 16.6926 numMergedOcc 0
25 mol 232 unq 3 iso 0 dist 8.27212 9.40808 4.9377 4.22149 9.27788 11.9664 8.80479 9.05071 9.8664 8.36223 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 7.56915 8.52587 5.29529 4.24652 9.83622 9.2199 6.20558 9.85289 6.88827 5.14522 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 7.56915 8.52587 5.29529 4.24652 9.83622 9.2199 16.3619 14.1515 9.16942 15.0518 numMergedOcc 0
