0 mol 18 unq 0 iso 0 dist 9.12848 9.2978 7.37821 8.25905 4.49033 5.01478 5.13088 11.5174 9.55948 11.0147 numMergedOcc 0
1 mol 70 unq 0 iso 0 dist 9.2794 6.77833 5.51579 8.06918 11.9871 6.65811 5.81368 13.7966 9.74802 6.22308 numMergedOcc 0
2 mol 70 unq 1 iso 0 dist 9.2794 6.77833 5.51579 7.52623 9.5704 5.47516 5.81368 13.7966 9.74802 7.0495 numMergedOcc 0
3 mol 70 unq 2 iso 0 dist 9.2794 6.77833 5.51579 5.62294 10.9277 11.0952 5.81368 13.7966 9.74802 10.2795 numMergedOcc 0
4 mol 122 unq 0 iso 0 dist 8.3907 8.47907 4.42285 9.55337 5.73775 5.41882 14.9119 12.5418 8.75778 13.4235 numMergedOcc 0
5 mol 126 unq 0 iso 0 dist 8.7347 7.02525 8.85684 6.35364 4.56139 5.15767 10.7956 13.0491 7.44723 8.62574 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 4.95674 4.49984 12.0863 16.6927 18.5863 9.1146 19.324 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 5.63173 8.95433 5.36939 9.59094 6.2062 4.68409 4.42593 5.84909 9.1146 7.46812 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 9.71025 7.34207 12.461 5.81632 6.28784 6.53652 6.84292 15.8484 6.36439 10.3914 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 9.08229 6.53913 5.48405 9.4422 10.9873 6.58937 13.5763 13.0903 9.23645 11.5728 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 7.99057 6.53913 10.8859 9.4422 12.2296 6.58937 13.5763 19.9299 9.23645 11.5728 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 8.22331 6.18446 7.56497 6.58245 4.40086 5.2908 4.80458 7.32228 8.67786 8.4273 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 4.91191 6.48196 6.52848 7.99897 5.3674 8.96098 4.26152 8.01777 7.41931 12.0539 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 6.54859 9.07222 4.71394 7.05868 4.52208 8.192 7.3073 6.94194 6.43046 10.8605 numMergedOcc 0
14 mol 236 unq 1 iso 0 dist 6.54859 9.09998 6.97964 7.05868 4.52208 6.90372 5.05395 10.5006 9.79948 9.33734 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 6.58667 9.38793 4.84657 9.28545 13.5948 17.5025 9.78665 8.99435 6.03235 18.9689 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.01542 9.38793 13.791 9.28545 4.29127 17.5025 9.78665 15.1763 6.03235 18.9689 numMergedOcc 0
