0 mol 34 unq 0 iso 0 dist 8.36524 5.39587 4.55481 10.9927 11.1344 7.61802 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 7.62383 9.79757 8.39998 8.64474 11.8166 8.82927 numMergedOcc 0
2 mol 152 unq 0 iso 0 dist 8.34839 9.4275 5.39112 9.3621 13.2594 9.77567 numMergedOcc 0
3 mol 169 unq 0 iso 0 dist 6.28961 8.89822 5.7891 14.0306 10.1104 6.4644 numMergedOcc 0
4 mol 186 unq 0 iso 0 dist 9.52413 8.9388 15.4336 8.50695 15.4026 5.09756 numMergedOcc 0
5 mol 206 unq 0 iso 0 dist 5.82039 9.36144 7.89575 7.72978 11.692 8.91548 numMergedOcc 0
6 mol 206 unq 1 iso 0 dist 6.22964 9.36144 5.14674 7.72978 6.18991 8.91548 numMergedOcc 0
7 mol 229 unq 0 iso 0 dist 6.32302 9.90415 5.70473 18.1749 15.3414 9.69367 numMergedOcc 0
8 mol 229 unq 1 iso 0 dist 6.88694 9.90415 7.22525 18.1749 14.7537 9.69367 numMergedOcc 0
9 mol 229 unq 2 iso 0 dist 8.53615 5.96615 5.70473 11.2221 15.3414 9.69367 numMergedOcc 0
10 mol 232 unq 0 iso 0 dist 7.57253 8.1692 5.42461 5.04399 6.94983 7.13253 numMergedOcc 0
11 mol 248 unq 0 iso 0 dist 7.40475 5.65458 7.48679 4.54692 11.5956 6.79869 numMergedOcc 0
12 mol 248 unq 1 iso 0 dist 7.40475 5.65458 7.48679 8.22506 10.2339 9.54938 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 7.151 9.22453 11.2997 13.4588 18.2066 8.20902 numMergedOcc 0
14 mol 277 unq 1 iso 0 dist 7.151 9.22453 11.2997 6.5109 10.0577 7.98589 numMergedOcc 0
15 mol 277 unq 2 iso 0 dist 8.53324 9.22453 4.40029 13.4588 12.4435 8.20902 numMergedOcc 0
16 mol 277 unq 3 iso 0 dist 8.53324 9.22453 4.40029 6.5109 8.23147 7.98589 numMergedOcc 0
17 mol 277 unq 4 iso 0 dist 7.23956 9.22453 3.97543 13.4588 6.86014 8.20902 numMergedOcc 0
18 mol 277 unq 5 iso 0 dist 7.23956 9.22453 3.97543 6.5109 6.49176 7.98589 numMergedOcc 0
