HEADER Ideal coordinates for PDB-CCD GLC COMPND GLC AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C1 GLC A 1 -0.567 1.572 -0.245 1.00 20.00 C HETATM 2 C2 GLC A 1 -1.578 0.465 -0.554 1.00 20.00 C HETATM 3 C3 GLC A 1 -1.179 -0.806 0.203 1.00 20.00 C HETATM 4 C4 GLC A 1 0.249 -1.195 -0.192 1.00 20.00 C HETATM 5 C5 GLC A 1 1.189 -0.024 0.102 1.00 20.00 C HETATM 6 C6 GLC A 1 2.607 -0.383 -0.345 1.00 20.00 C HETATM 7 O1 GLC A 1 -0.600 1.871 1.151 1.00 20.00 O HETATM 8 O2 GLC A 1 -2.881 0.879 -0.139 1.00 20.00 O HETATM 9 O3 GLC A 1 -2.075 -1.866 -0.137 1.00 20.00 O HETATM 10 O4 GLC A 1 0.658 -2.338 0.562 1.00 20.00 O HETATM 11 O5 GLC A 1 0.744 1.133 -0.608 1.00 20.00 O HETATM 12 O6 GLC A 1 3.506 0.661 0.035 1.00 20.00 O HETATM 13 H1 GLC A 1 -0.822 2.466 -0.815 1.00 20.00 H HETATM 14 H2 GLC A 1 -1.583 0.264 -1.626 1.00 20.00 H HETATM 15 H3 GLC A 1 -1.223 -0.619 1.276 1.00 20.00 H HETATM 16 H4 GLC A 1 0.281 -1.429 -1.257 1.00 20.00 H HETATM 17 H5 GLC A 1 1.187 0.184 1.173 1.00 20.00 H HETATM 18 H61 GLC A 1 2.913 -1.315 0.129 1.00 20.00 H HETATM 19 H62 GLC A 1 2.627 -0.503 -1.428 1.00 20.00 H HETATM 20 HO1 GLC A 1 0.017 2.566 1.420 1.00 20.00 H HETATM 21 HO2 GLC A 1 -3.197 1.682 -0.576 1.00 20.00 H HETATM 22 HO3 GLC A 1 -3.000 -1.684 0.080 1.00 20.00 H HETATM 23 HO4 GLC A 1 0.102 -3.118 0.427 1.00 20.00 H HETATM 24 HO6 GLC A 1 4.425 0.501 -0.218 1.00 20.00 H CONECT 1 2 7 11 13 CONECT 2 3 8 14 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