0 mol 17 unq 0 iso 0 dist 6.62838 14.7318 8.48453 13.5595 7.02884 4.03817 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 6.62838 14.2253 8.80499 13.5595 7.02884 5.12703 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 4.8921 12.4159 8.48453 10.3706 7.02884 4.03817 numMergedOcc 0
3 mol 17 unq 3 iso 0 dist 4.8921 10.7915 8.80499 10.3706 7.02884 5.12703 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 8.27044 11.5541 6.44693 10.4527 9.63181 7.77965 numMergedOcc 0
5 mol 27 unq 0 iso 0 dist 8.15117 9.13877 8.28463 7.71155 6.75307 6.65855 numMergedOcc 0
6 mol 27 unq 1 iso 0 dist 8.15117 9.13877 8.28463 10.3774 7.24775 14.3929 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 8.05585 10.4302 8.60577 10.6881 5.39827 9.23414 numMergedOcc 0
8 mol 65 unq 0 iso 0 dist 6.47678 6.92714 9.38611 7.67264 8.58416 6.47381 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 7.80999 4.5238 5.94478 9.00694 9.61913 9.91049 numMergedOcc 0
10 mol 189 unq 0 iso 0 dist 8.21424 10.76 9.58744 5.77635 7.45329 10.1941 numMergedOcc 0
11 mol 253 unq 0 iso 0 dist 6.54733 5.9993 7.0247 4.91528 8.70383 5.78064 numMergedOcc 0
12 mol 276 unq 0 iso 0 dist 7.29754 12.0736 7.11272 10.7895 8.74282 6.51623 numMergedOcc 0
13 mol 276 unq 1 iso 0 dist 7.29754 5.82478 6.24808 10.7895 8.74282 5.41235 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 9.3985 4.88818 9.58494 11.4074 8.71212 7.66477 numMergedOcc 0
15 mol 278 unq 1 iso 0 dist 9.3985 4.88818 9.58494 9.53871 8.60481 9.96924 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.01242 5.9862 9.22576 10.1742 9.52718 4.9628 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 8.01242 5.9862 9.22576 10.1742 9.52718 4.9628 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 8.01242 5.9862 9.22576 10.1742 9.52718 4.9628 numMergedOcc 0
