0 mol 7 unq 0 iso 0 dist 8.85869 14.1047 9.85726 12.2583 10.4879 7.32392 19.2577 11.5784 9.60499 15.5277 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.72142 5.40044 8.47315 9.15653 10.2869 8.59049 6.28033 5.59769 4.7319 5.70228 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.17472 5.3372 6.87871 8.16211 5.41061 5.2422 13.0456 8.95909 9.24927 5.74753 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.85094 7.15161 5.92705 9.65026 6.47853 9.70415 10.5531 5.4671 6.65721 5.46309 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 6.85094 7.15161 5.92705 9.65026 6.47853 9.70415 13.6393 10.1513 6.72123 11.9897 numMergedOcc 0
5 mol 61 unq 2 iso 0 dist 9.94756 18.7183 9.62468 23.9088 14.0458 9.70415 20.4711 10.7369 6.65721 5.46309 numMergedOcc 0
6 mol 61 unq 3 iso 0 dist 9.94756 18.7183 9.62468 23.9088 14.0458 9.70415 19.7171 11.5608 6.72123 11.9897 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.24519 5.34484 7.70533 9.14994 10.7285 7.0318 8.81172 6.29427 9.84395 8.12649 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 5.24519 5.34484 7.70533 9.14994 10.7285 7.0318 11.6152 14.3476 7.90328 5.21051 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 5.50364 5.29825 8.97145 9.12773 7.31861 8.99949 12.0117 14.257 6.85062 11.3502 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 8.7301 5.29825 6.5874 9.12773 4.55152 8.99949 12.0117 7.60371 6.85062 11.3502 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 8.79185 5.59399 6.71202 10.9621 4.87536 9.68507 7.11647 5.70205 7.66148 9.75709 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 4.3362 9.20027 7.31105 13.1043 9.98645 6.21273 17.1012 14.6296 9.23153 5.1021 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 4.3362 9.20027 7.31105 13.1043 9.98645 6.21273 13.6374 9.52692 8.24498 6.29601 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 4.21935 4.77446 6.37342 9.01934 5.39741 8.61729 6.83046 5.29737 6.16342 7.02319 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 6.59521 5.13233 8.58088 10.7357 7.42035 8.9706 10.7821 10.221 6.60405 5.70285 numMergedOcc 0
16 mol 258 unq 1 iso 0 dist 6.59521 5.13233 8.58088 10.7357 7.42035 8.9706 8.21585 9.22664 6.42289 6.50871 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 5.68643 7.48637 9.91395 11.5007 9.91966 8.30175 8.78883 4.97216 9.10818 5.55557 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 8.17922 10.374 7.80446 13.3181 5.44831 8.30175 13.261 6.57235 9.10818 5.55557 numMergedOcc 0
