0 mol 10 unq 0 iso 0 dist 9.30107 6.88548 4.89243 9.40965 15.1293 13.119 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.30107 6.88548 4.89243 4.89792 8.12738 4.71687 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.84355 6.44893 10.4706 5.42968 11.1055 4.21283 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.84355 6.44893 10.4706 5.94343 11.2879 4.97191 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 8.02713 6.40398 5.24517 7.92586 9.55457 12.0238 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 8.77374 9.93908 7.41457 7.88265 11.6654 6.97032 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.23558 9.05365 6.03779 6.36631 12.827 13.4717 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 9.23558 9.05365 6.03779 6.24308 10.6354 12.1644 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 9.23558 9.05365 6.03779 6.66182 3.38043 3.86677 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 8.47929 7.90691 11.0152 7.66528 11.6457 4.21194 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 8.47929 8.83011 7.33078 7.66528 11.6457 9.46982 numMergedOcc 0
11 mol 128 unq 2 iso 0 dist 9.71728 7.90691 11.0542 7.66528 13.5215 4.21194 numMergedOcc 0
12 mol 128 unq 3 iso 0 dist 9.71728 8.83011 5.34549 7.66528 13.5215 9.46982 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 8.88105 5.32135 8.77064 7.37255 5.94889 6.02991 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.30192 6.59729 6.11242 8.86574 12.5023 9.42515 numMergedOcc 0
15 mol 189 unq 0 iso 0 dist 8.91697 9.5853 6.90931 8.49359 5.8269 8.73039 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 8.27047 6.47064 5.33482 8.32382 9.61033 12.1428 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 5.87353 9.91954 10.3695 6.26593 6.77462 8.89888 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 7.87214 9.91954 12.0773 6.26593 3.91293 8.89888 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 6.76971 6.42743 3.96671 7.8046 11.6467 11.7851 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 9.68891 6.42743 7.10367 7.8046 9.44473 11.7851 numMergedOcc 0
