HEADER Model coordinates for PDB-CCD FRU COMPND FRU AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C1 FRU A 1 -6.763 20.037 85.842 1.00 20.00 C HETATM 2 C2 FRU A 1 -7.004 18.781 84.967 1.00 20.00 C HETATM 3 C3 FRU A 1 -7.244 17.468 85.783 1.00 20.00 C HETATM 4 C4 FRU A 1 -6.885 16.423 84.693 1.00 20.00 C HETATM 5 C5 FRU A 1 -5.586 17.071 84.173 1.00 20.00 C HETATM 6 C6 FRU A 1 -5.172 16.631 82.793 1.00 20.00 C HETATM 7 O1 FRU A 1 -5.779 19.828 86.850 1.00 20.00 O HETATM 8 O2 FRU A 1 -8.144 19.005 84.091 1.00 20.00 O HETATM 9 O3 FRU A 1 -8.614 17.357 86.194 1.00 20.00 O HETATM 10 O4 FRU A 1 -6.688 15.124 85.236 1.00 20.00 O HETATM 11 O5 FRU A 1 -5.832 18.505 84.123 1.00 20.00 O HETATM 12 O6 FRU A 1 -3.807 16.950 82.588 1.00 20.00 O HETATM 13 H11 FRU A 1 -6.506 20.919 85.211 1.00 20.00 H HETATM 14 H12 FRU A 1 -7.717 20.403 86.286 1.00 20.00 H HETATM 15 H3 FRU A 1 -6.666 17.378 86.732 1.00 20.00 H HETATM 16 H4 FRU A 1 -7.663 16.236 83.917 1.00 20.00 H HETATM 17 H5 FRU A 1 -4.761 16.765 84.859 1.00 20.00 H HETATM 18 H61 FRU A 1 -5.385 15.551 82.612 1.00 20.00 H HETATM 19 H62 FRU A 1 -5.828 17.057 81.999 1.00 20.00 H HETATM 20 HO1 FRU A 1 -5.631 20.598 87.386 1.00 20.00 H HETATM 21 HO2 FRU A 1 -8.291 18.235 83.554 1.00 20.00 H HETATM 22 HO3 FRU A 1 -8.759 16.559 86.689 1.00 20.00 H HETATM 23 HO4 FRU A 1 -6.468 14.484 84.568 1.00 20.00 H HETATM 24 HO6 FRU A 1 -3.545 16.672 81.717 1.00 20.00 H CONECT 1 2 7 13 14 CONECT 2 3 8 11 CONECT 3 4 9 15 CONECT 4 5 10 16 CONECT 5 6 11 17 CONECT 6 12 18 19 CONECT 7 20 CONECT 8 21 CONECT 9 22 CONECT 10 23 CONECT 12 24 END