0 mol 7 unq 0 iso 0 dist 6.10226 8.88982 5.70161 11.2808 6.0323 7.15434 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.80034 8.88982 4.57188 9.77686 8.85869 12.3221 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.83056 8.88982 6.09254 9.77686 7.5298 12.3221 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.83056 8.88982 6.09254 16.9579 8.94874 11.9671 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 6.71884 9.95691 10.9362 5.56177 8.96223 15.3576 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 8.84888 5.45787 12.692 4.94564 7.58484 10.4011 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 5.38954 9.60425 6.29427 6.63536 5.24519 8.81172 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 9.29989 8.75736 15.7012 5.50185 6.4922 12.9804 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 9.29989 6.32178 10.0029 5.50185 6.4922 10.1361 numMergedOcc 0
9 mol 140 unq 0 iso 0 dist 9.83976 6.40792 12.1389 6.09043 9.74209 7.83582 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.22039 8.67129 7.20524 4.27597 9.98097 7.97349 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.4588 8.84116 9.45235 13.4487 8.40343 16.3554 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.4588 8.16369 10.591 13.4487 8.40343 13.7557 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 9.47309 8.47457 13.2364 9.23449 4.99301 12.5914 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 5.62744 6.92721 5.29737 5.32735 4.21935 6.83046 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 9.67923 7.58175 4.98533 13.462 7.74647 6.41821 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 8.8726 5.31858 9.22664 5.06393 6.59521 8.21585 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 8.8726 5.71851 13.0489 5.06393 6.59521 10.6274 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 8.13376 8.69345 14.41 8.59148 9.2772 15.4503 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 5.14122 8.59825 7.8929 8.48131 8.19772 15.2065 numMergedOcc 0
20 mol 265 unq 1 iso 0 dist 5.14122 7.83102 5.56416 8.48131 8.19772 11.7979 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 5.72197 7.34596 4.58403 4.87828 6.40686 10.161 numMergedOcc 0
22 mol 282 unq 1 iso 0 dist 5.72197 7.12228 5.04235 4.87828 6.40686 9.83042 numMergedOcc 0
