0 mol 0 unq 0 iso 0 dist 9.42137 14.5258 7.15528 5.66453 6.26831 9.19662 13.5016 5.47921 6.94181 9.83355 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 13.0772 6.90155 9.36158 12.1406 4.96681 9.22151 9.75994 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.40051 14.4191 7.17969 13.0772 6.90155 10.1525 12.1406 4.96681 6.22122 9.75994 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.7522 15.0931 8.34347 14.6525 8.44506 13.2876 15.7779 6.4487 7.51406 11.4622 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.58793 7.83419 7.66905 4.81974 7.33422 10.121 12.8498 13.5384 6.56728 16.145 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 4.98864 6.59772 6.11741 5.01124 5.74857 6.08806 5.87592 5.19652 8.97043 9.73461 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 7.95871 4.86477 6.11741 7.39793 5.74857 6.08806 8.37388 5.19652 8.97043 9.73461 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 5.63005 10.5268 8.73993 9.79485 8.56342 4.91132 15.5348 10.5726 8.88255 10.4602 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 5.63005 10.5268 8.73993 6.81112 6.37542 6.08167 15.5348 10.5726 8.88255 11.794 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 8.32241 4.84035 6.06638 5.93497 9.46588 5.5703 10.6754 5.50061 6.24392 9.31118 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 7.78418 8.92743 11.6847 13.0602 5.65373 8.8557 11.5087 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 8.6537 10.7439 7.03423 7.78418 8.92743 9.62106 13.0602 5.65373 5.00457 11.5087 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 5.73834 7.52881 6.42289 10.6333 9.53063 5.27959 6.41167 5.13233 8.21585 12.9634 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 6.42725 8.70769 5.30224 12.2782 8.59697 7.31951 11.4709 5.43184 8.57619 8.30744 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 8.65236 4.49913 9.14619 3.67304 5.26434 6.04016 10.8849 10.9571 6.82526 10.7186 numMergedOcc 0
15 mol 261 unq 1 iso 0 dist 9.73983 4.49913 8.45658 3.67304 8.60026 6.04016 10.8849 10.3274 6.82526 10.7186 numMergedOcc 0
