0 mol 18 unq 0 iso 0 dist 9.12848 8.25905 4.49033 4.84965 8.2056 5.03976 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 7.62792 9.99989 9.08976 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 7.62792 6.42206 9.08976 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.32868 6.97484 11.9916 6.7999 13.3051 8.20798 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 7.11556 9.9443 7.62048 7.16986 9.79412 6.18729 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 6.15185 9.9443 8.44086 7.16986 8.65822 6.18729 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.49649 8.80672 14.5276 12.021 17.7245 6.33375 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 8.95136 6.37411 15.2718 4.86574 12.8656 5.24645 numMergedOcc 0
8 mol 233 unq 0 iso 0 dist 8.36772 5.34745 8.95188 9.27865 14.9958 7.40764 numMergedOcc 0
9 mol 233 unq 1 iso 0 dist 8.83541 5.34745 5.19341 9.27865 11.9797 7.40764 numMergedOcc 0
10 mol 233 unq 2 iso 0 dist 7.55878 5.34745 5.3674 9.27865 7.24533 7.40764 numMergedOcc 0
11 mol 233 unq 3 iso 0 dist 4.91191 7.99897 5.3674 4.98124 7.24533 7.40764 numMergedOcc 0
12 mol 233 unq 4 iso 0 dist 7.89581 8.98366 5.19341 11.6509 11.9797 7.40764 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 13.9126 9.13615 6.553 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 6.91126 6.43838 5.85485 12.4867 10.5762 7.8126 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 6.91126 9.24964 14.9183 6.17988 12.628 7.79898 numMergedOcc 0
16 mol 235 unq 2 iso 0 dist 9.48967 6.43838 15.6099 12.4867 19.7559 7.8126 numMergedOcc 0
17 mol 235 unq 3 iso 0 dist 9.48967 9.24964 4.28284 6.17988 10.6732 7.79898 numMergedOcc 0
18 mol 235 unq 4 iso 0 dist 6.43002 5.71896 4.28284 6.14767 10.6732 7.79898 numMergedOcc 0
19 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 4.9935 10.5223 9.06037 numMergedOcc 0
20 mol 247 unq 1 iso 0 dist 6.35578 6.34304 4.32191 6.74468 9.79737 8.09208 numMergedOcc 0
