0 mol 7 unq 0 iso 0 dist 6.72215 9.19844 10.5551 5.38502 9.60499 7.5706 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.39221 7.87063 8.97241 7.00835 6.38364 11.8971 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 8.39221 5.93401 8.94163 7.00835 6.38364 10.5825 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.59893 6.95846 8.17454 11.9881 9.5589 7.56581 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.59893 6.95846 8.17454 10.3564 6.83299 9.22021 numMergedOcc 0
5 mol 54 unq 2 iso 0 dist 6.59893 6.95846 8.17454 12.4254 8.10861 14.1587 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.48625 8.91274 5.64744 6.34264 7.17396 8.49118 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 6.48625 8.91274 5.64744 5.30842 9.21998 12.672 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.62468 8.3539 15.1094 10.7369 6.65721 16.4159 numMergedOcc 0
9 mol 61 unq 1 iso 0 dist 9.62468 8.3539 15.1094 11.5608 6.72123 19.1712 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 9.68526 8.91833 15.9091 8.31041 9.38498 9.33919 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 7.26679 8.91833 7.9151 8.31041 9.96396 9.33919 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 7.26679 8.91833 7.9151 5.44275 6.19304 9.79143 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 7.26679 8.91833 7.9151 11.2674 8.70481 6.43377 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 9.30776 8.91833 5.44172 8.31041 9.75218 9.33919 numMergedOcc 0
15 mol 127 unq 0 iso 0 dist 8.40046 6.99723 10.7123 9.75166 9.30299 5.72373 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.48243 6.98375 5.32028 11.6637 9.91388 11.8599 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 9.00898 7.59434 5.32538 5.96451 9.29945 6.95549 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 7.44191 9.87183 5.87996 9.60754 8.03334 12.0793 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 5.89084 9.71144 8.83842 4.74041 6.56247 7.72403 numMergedOcc 0
20 mol 234 unq 1 iso 0 dist 5.89084 9.71144 8.83842 6.16697 9.45496 6.35438 numMergedOcc 0
21 mol 234 unq 2 iso 0 dist 8.47009 9.71144 5.43327 4.74041 9.36357 7.72403 numMergedOcc 0
22 mol 234 unq 3 iso 0 dist 8.47009 9.71144 5.43327 6.16697 6.7625 6.35438 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 6.37342 7.84904 4.86449 5.29737 6.16342 5.45139 numMergedOcc 0
24 mol 248 unq 0 iso 0 dist 7.66519 9.64167 8.27027 6.42363 9.56569 11.2609 numMergedOcc 0
25 mol 252 unq 0 iso 0 dist 9.73021 7.3701 10.4807 16.5881 8.33025 15.5026 numMergedOcc 0
26 mol 252 unq 1 iso 0 dist 9.73021 7.3701 10.4807 12.5855 9.2288 14.2931 numMergedOcc 0
27 mol 252 unq 2 iso 0 dist 9.73021 7.3701 10.4807 5.26867 7.19638 10.8046 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 6.90434 9.25134 14.8109 13.2927 9.7748 19.81 numMergedOcc 0
