0 mol 14 unq 0 iso 0 dist 8.79533 9.31271 16.5607 10.3326 18.2908 9.04767 16.1898 22.5694 11.3111 8.60571 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.72142 6.28033 5.59769 5.40044 8.47315 4.7319 9.15653 10.2869 5.70228 8.59049 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.67023 5.26018 6.86126 10.3287 12.0739 7.34143 16.0906 16.2569 13.9113 7.70026 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 6.86785 7.1203 6.55558 6.03647 9.90304 7.34143 12.6699 14.9989 13.9113 7.70026 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 8.71615 6.7212 5.46166 11.6369 15.4232 9.96708 15.3732 20.2556 15.0607 6.68311 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 5.24519 8.81172 6.29427 5.34484 7.70533 9.84395 9.14994 10.7285 8.12649 7.0318 numMergedOcc 0
6 mol 117 unq 1 iso 0 dist 8.30003 7.0318 10.4589 8.12649 12.1493 9.84395 9.14994 8.93179 5.34484 8.81172 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 7.26463 8.88255 9.35307 10.5726 15.5753 8.73993 7.55428 10.0673 4.6251 8.62648 numMergedOcc 0
8 mol 142 unq 0 iso 0 dist 9.5355 7.15087 13.1936 5.50176 10.5524 5.31024 13.0533 16.4668 6.3846 9.14908 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 6.67598 7.11647 5.75141 5.59399 10.6034 7.66148 10.9621 13.5806 9.75709 9.68507 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 8.98636 7.11647 5.6208 5.59399 10.2601 7.66148 10.9621 15.2726 9.75709 9.68507 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 8.79185 7.11647 5.70205 5.59399 6.71202 7.66148 10.9621 4.87536 9.75709 9.68507 numMergedOcc 0
12 mol 156 unq 3 iso 0 dist 9.04176 9.68507 4.08699 9.75709 10.543 7.66148 10.9621 6.56752 5.59399 7.11647 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 4.21935 6.83046 5.29737 4.77446 6.37342 6.16342 9.01934 5.39741 7.02319 8.61729 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.59521 8.21585 9.22664 5.13233 8.58088 6.42289 10.7357 7.42035 6.50871 8.9706 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 9.56414 9.95681 4.50761 5.79827 10.2386 8.02547 13.8468 14.6403 10.3933 8.17205 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 9.56414 9.05762 8.80293 5.79827 10.2386 6.05727 13.8468 14.6403 7.8624 8.17205 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 8.99974 8.78883 8.19222 7.48637 14.4561 9.10818 11.5007 13.0549 5.55557 8.30175 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 5.68643 8.78883 4.97216 7.48637 9.91395 9.10818 11.5007 9.91966 5.55557 8.30175 numMergedOcc 0
19 mol 274 unq 2 iso 0 dist 8.36043 8.78883 10.2686 7.48637 13.4473 9.10818 11.5007 15.3761 5.55557 8.30175 numMergedOcc 0
