0 mol 12 unq 0 iso 0 dist 8.3933 5.93993 8.15864 6.13335 5.70264 5.44478 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 7.48334 5.24476 7.44913 9.56015 5.15367 7.14979 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 7.44693 9.09433 8.43162 12.5281 7.29064 6.57749 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 8.71613 8.12626 6.53824 13.5972 5.14974 8.74019 numMergedOcc 0
4 mol 124 unq 0 iso 0 dist 6.31955 4.04981 7.18976 9.08158 8.28232 6.31232 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 6.45731 12.523 8.64054 14.3253 8.54767 9.30597 numMergedOcc 0
6 mol 136 unq 0 iso 0 dist 9.87892 9.61557 8.41727 6.6829 6.29723 9.67457 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 9.20602 10.7142 6.8976 12.7308 7.20013 6.66184 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 6.76048 6.31999 9.38856 12.6144 13.5755 6.45502 numMergedOcc 0
9 mol 158 unq 1 iso 0 dist 6.76048 6.31999 9.38856 13.1704 12.9207 8.66056 numMergedOcc 0
10 mol 158 unq 2 iso 0 dist 8.57243 11.0811 9.96635 15.6721 10.6035 8.34722 numMergedOcc 0
11 mol 182 unq 0 iso 0 dist 8.40125 6.98552 8.27913 10.1095 4.60682 7.03216 numMergedOcc 0
12 mol 182 unq 1 iso 0 dist 8.40125 6.02785 8.85111 10.1095 4.60682 9.42196 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 9.83755 8.77825 4.36421 11.1115 13.587 9.66533 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 7.35578 8.54715 6.80214 11.5577 7.16053 5.2376 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 8.90583 4.09525 8.74399 8.99521 5.92917 7.6174 numMergedOcc 0
16 mol 245 unq 0 iso 0 dist 9.93922 13.4565 9.96585 17.7842 9.95653 7.1207 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 8.89995 5.38165 7.74965 10.9221 10.8669 5.62295 numMergedOcc 0
