0 mol 4 unq 0 iso 0 dist 9.16533 10.8791 9.31104 6.10734 5.5797 7.35416 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.16533 10.8791 9.31104 15.6929 9.88817 6.42755 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 5.96073 5.86578 6.17406 10.26 10.8146 7.35972 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.58825 6.72679 6.71313 12.4564 13.3903 8.29857 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.9138 9.82137 6.84692 7.1754 4.71426 9.5057 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 8.9138 4.42919 5.74152 7.1754 4.71426 5.75014 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.04727 11.2751 7.84048 12.7467 4.29098 6.84835 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 6.53076 9.21862 7.03303 11.9882 7.23254 5.25109 numMergedOcc 0
8 mol 171 unq 1 iso 0 dist 6.53076 9.21862 7.03303 14.8027 8.97143 8.21618 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 8.28887 10.4244 5.67863 14.2824 9.82808 6.38324 numMergedOcc 0
10 mol 194 unq 1 iso 0 dist 8.28887 12.4855 9.42308 14.2824 9.82808 6.1886 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 7.27805 4.97624 8.73772 6.82883 6.20334 5.70795 numMergedOcc 0
12 mol 226 unq 1 iso 0 dist 8.03683 5.55393 8.73772 8.22518 6.20334 5.70795 numMergedOcc 0
13 mol 244 unq 0 iso 0 dist 9.09654 11.4169 6.61951 5.60146 5.01275 6.22122 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.40398 4.48276 7.1364 11.3455 4.45928 7.75216 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 8.55229 6.84952 5.0002 12.6353 4.67674 6.88827 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 8.55229 6.84952 5.0002 12.12 11.1431 9.16942 numMergedOcc 0
