HEADER Model coordinates for PDB-CCD NAG COMPND NAG AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C1 NAG A 1 7.396 28.163 26.662 1.00 20.00 C HETATM 2 C2 NAG A 1 6.973 29.233 27.644 1.00 20.00 C HETATM 3 C3 NAG A 1 7.667 29.055 29.000 1.00 20.00 C HETATM 4 C4 NAG A 1 7.573 27.588 29.490 1.00 20.00 C HETATM 5 C5 NAG A 1 7.902 26.592 28.373 1.00 20.00 C HETATM 6 C6 NAG A 1 7.599 25.173 28.797 1.00 20.00 C HETATM 7 C7 NAG A 1 6.291 31.299 26.595 1.00 20.00 C HETATM 8 C8 NAG A 1 6.684 32.649 26.036 1.00 20.00 C HETATM 9 N2 NAG A 1 7.268 30.545 27.089 1.00 20.00 N HETATM 10 O1 NAG A 1 6.676 28.363 25.419 1.00 20.00 O HETATM 11 O3 NAG A 1 7.038 29.909 29.947 1.00 20.00 O HETATM 12 O4 NAG A 1 8.494 27.358 30.574 1.00 20.00 O HETATM 13 O5 NAG A 1 7.104 26.875 27.206 1.00 20.00 O HETATM 14 O6 NAG A 1 6.232 25.040 29.165 1.00 20.00 O HETATM 15 O7 NAG A 1 5.114 30.936 26.562 1.00 20.00 O HETATM 16 H1 NAG A 1 8.477 28.257 26.481 1.00 20.00 H HETATM 17 H2 NAG A 1 5.888 29.146 27.803 1.00 20.00 H HETATM 18 H3 NAG A 1 8.729 29.321 28.892 1.00 20.00 H HETATM 19 H4 NAG A 1 6.544 27.403 29.831 1.00 20.00 H HETATM 20 H5 NAG A 1 8.971 26.674 28.128 1.00 20.00 H HETATM 21 H61 NAG A 1 7.816 24.492 27.961 1.00 20.00 H HETATM 22 H62 NAG A 1 8.232 24.910 29.657 1.00 20.00 H HETATM 23 H81 NAG A 1 5.791 33.159 25.646 1.00 20.00 H HETATM 24 H82 NAG A 1 7.136 33.258 26.833 1.00 20.00 H HETATM 25 H83 NAG A 1 7.411 32.511 25.222 1.00 20.00 H HETATM 26 HN2 NAG A 1 8.210 30.881 27.079 1.00 20.00 H HETATM 27 HO1 NAG A 1 6.933 27.696 24.793 1.00 20.00 H HETATM 28 HO3 NAG A 1 7.459 29.809 30.793 1.00 20.00 H HETATM 29 HO4 NAG A 1 8.425 26.456 30.863 1.00 20.00 H HETATM 30 HO6 NAG A 1 6.060 24.143 29.428 1.00 20.00 H CONECT 1 2 10 13 16 CONECT 2 3 9 17 CONECT 3 4 11 18 CONECT 4 5 12 19 CONECT 5 6 13 20 CONECT 6 14 21 22 CONECT 7 8 9 15 15 CONECT 8 23 24 25 CONECT 9 26 CONECT 10 27 CONECT 11 28 CONECT 12 29 CONECT 14 30 END