0 mol 6 unq 0 iso 0 dist 9.92941 8.96273 9.70457 9.77248 8.8237 5.4574 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 8.7812 11.063 6.30355 9.76503 7.55864 9.4232 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 6.29578 11.063 6.02975 9.76503 9.33568 9.4232 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 9.17864 5.61813 9.64066 8.27934 7.48283 4.30029 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 9.39373 9.91513 9.64066 10.5358 7.48283 4.30029 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 9.21347 10.6955 8.96089 5.64836 7.17412 9.98904 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 6.10881 5.81013 9.61954 4.8716 8.76367 5.11292 numMergedOcc 0
7 mol 197 unq 0 iso 0 dist 7.26706 6.73386 6.20676 9.99486 5.5343 4.31461 numMergedOcc 0
8 mol 197 unq 1 iso 0 dist 5.97267 6.73386 7.36576 9.99486 8.8252 4.31461 numMergedOcc 0
9 mol 197 unq 2 iso 0 dist 8.80739 12.9164 7.36576 16.1948 8.8252 4.31461 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 9.46363 10.4308 9.95282 11.4312 5.10016 10.0214 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 6.47032 9.44535 7.39796 10.0531 5.05353 8.26463 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 6.62385 9.65777 7.39796 5.28769 5.05353 8.26463 numMergedOcc 0
13 mol 220 unq 2 iso 0 dist 5.3841 4.96764 7.39796 5.63117 5.05353 8.26463 numMergedOcc 0
14 mol 247 unq 0 iso 0 dist 9.90771 10.2746 6.16117 13.2112 6.50869 6.67746 numMergedOcc 0
15 mol 247 unq 1 iso 0 dist 9.90771 10.2746 6.16117 7.25767 9.54682 9.74878 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.14345 9.52861 8.42773 6.9617 8.14526 10.7991 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.14345 9.52861 8.42773 7.10065 7.94491 4.98212 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 8.14345 9.52861 8.42773 6.41332 7.75803 13.0438 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 9.4458 10.536 9.27648 5.58886 9.55134 6.30922 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 8.9745 14.4955 9.27648 10.2235 9.55134 6.30922 numMergedOcc 0
