0 mol 34 unq 0 iso 0 dist 6.72467 8.58962 5.48936 6.71226 8.82122 6.40741 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.61926 9.23947 6.90629 10.8544 9.14856 11.9735 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 5.92974 7.78176 6.13989 5.27212 7.19209 11.722 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 6.00131 8.96747 10.2475 5.88809 8.15367 12.1543 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 6.793 9.2062 6.34242 5.51997 9.50209 11.9963 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 5.45159 9.00087 6.91576 4.24061 8.20636 11.0782 numMergedOcc 0
6 mol 127 unq 1 iso 0 dist 5.45159 9.00087 6.91576 11.1968 8.03243 9.90296 numMergedOcc 0
7 mol 127 unq 2 iso 0 dist 4.9835 8.66991 6.91576 9.66028 8.20636 11.0782 numMergedOcc 0
8 mol 127 unq 3 iso 0 dist 4.9835 8.66991 6.91576 6.02157 8.03243 9.90296 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 9.6818 9.77522 6.80406 4.93993 6.96704 5.08863 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 7.33162 8.79135 11.8576 15.6753 9.25763 18.2049 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 7.33162 8.79135 11.8576 16.6412 9.63102 20.445 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 7.89936 7.63191 10.6304 5.21449 9.96798 6.14304 numMergedOcc 0
13 mol 254 unq 0 iso 0 dist 8.5372 7.28781 6.6011 9.73538 9.89583 10.6914 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 6.59786 9.57659 7.87765 10.41 8.41674 15.4122 numMergedOcc 0
15 mol 273 unq 1 iso 0 dist 6.59786 9.57659 7.87765 4.62586 6.8391 11.3754 numMergedOcc 0
16 mol 273 unq 2 iso 0 dist 6.59786 7.8424 6.45094 10.41 8.41674 14.6259 numMergedOcc 0
17 mol 273 unq 3 iso 0 dist 6.59786 7.8424 6.45094 4.62586 6.8391 11.0319 numMergedOcc 0
18 mol 273 unq 4 iso 0 dist 7.96519 9.57659 8.14134 4.62586 6.06557 11.3754 numMergedOcc 0
19 mol 273 unq 5 iso 0 dist 7.96519 7.8424 10.826 4.62586 6.06557 11.0319 numMergedOcc 0
