0 mol 56 unq 0 iso 0 dist 8.70353 4.27997 9.01516 12.528 5.07125 13.6231 numMergedOcc 0
1 mol 56 unq 1 iso 0 dist 8.70353 15.3001 7.31255 12.528 5.07125 8.33154 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 6.91361 6.41542 8.70888 4.54306 6.83746 10.3972 numMergedOcc 0
3 mol 170 unq 0 iso 0 dist 5.42919 5.2781 5.59924 5.03025 5.13268 5.37396 numMergedOcc 0
4 mol 171 unq 0 iso 0 dist 5.94881 14.3054 9.7578 4.61696 8.999 14.7654 numMergedOcc 0
5 mol 171 unq 1 iso 0 dist 5.94881 9.98671 9.85967 4.61696 8.999 13.1165 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 5.01585 7.17263 8.44479 7.29413 7.17037 6.21272 numMergedOcc 0
7 mol 173 unq 1 iso 0 dist 5.01585 5.82665 9.00002 7.29413 7.17037 10.8086 numMergedOcc 0
8 mol 193 unq 0 iso 0 dist 9.07517 5.17567 7.46207 14.5432 7.39445 14.5951 numMergedOcc 0
9 mol 212 unq 0 iso 0 dist 8.18732 12.1964 7.90906 5.93575 5.50658 11.9025 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 9.34695 17.4703 9.42463 6.38826 9.57955 16.704 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 9.34695 17.4703 9.42463 11.0792 8.79277 10.6864 numMergedOcc 0
12 mol 250 unq 0 iso 0 dist 5.01762 12.8652 9.84682 9.20475 7.22664 4.59201 numMergedOcc 0
13 mol 250 unq 1 iso 0 dist 5.01762 12.8652 9.84682 4.62181 7.15762 10.7903 numMergedOcc 0
14 mol 250 unq 2 iso 0 dist 5.01762 5.50681 8.26719 9.20475 7.22664 12.7172 numMergedOcc 0
15 mol 250 unq 3 iso 0 dist 5.01762 5.50681 8.26719 4.62181 7.15762 8.25498 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 8.43465 13.1839 9.54836 4.66338 6.02757 8.52745 numMergedOcc 0
17 mol 264 unq 1 iso 0 dist 8.43465 13.1839 9.54836 9.41519 8.67231 4.96942 numMergedOcc 0
