0 mol 25 unq 0 iso 0 dist 9.23015 4.54526 7.44277 12.2829 10.1908 8.27137 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 5.39587 10.0272 7.01952 12.2054 12.188 9.81143 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 5.39587 6.65242 4.58552 12.2054 12.188 9.78839 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 8.15039 10.9165 8.77529 11.9795 7.2452 7.93171 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.62245 6.18487 5.42044 4.9418 3.86836 4.49975 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 8.54304 9.02908 7.65564 14.5797 8.29196 8.42219 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 9.47287 9.41378 7.5573 14.8556 9.25976 5.82945 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 9.00537 12.9635 8.5672 10.561 3.6848 6.26168 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 8.9388 4.68208 8.5672 6.22466 3.6848 6.26168 numMergedOcc 0
9 mol 186 unq 2 iso 0 dist 8.95209 12.4508 5.86483 16.6933 10.9974 9.18289 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 6.27266 4.7754 8.22795 5.7709 3.7157 8.60546 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.13526 4.94644 6.69042 10.318 10.9673 6.0033 numMergedOcc 0
12 mol 207 unq 0 iso 0 dist 7.25953 7.22657 4.76113 10.3145 6.29106 6.50724 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.63804 6.42324 8.14294 10.8365 4.91709 8.86886 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 8.61619 6.42324 5.72 10.8365 5.96186 8.86886 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 6.0751 6.49444 9.01338 7.55878 3.98113 8.7831 numMergedOcc 0
