HEADER    Model coordinates
 for PDB-CCD NDG
COMPND    NDG
AUTHOR    pdbccdutils 0.8.6
AUTHOR    RDKit 2023.09.6
HETATM    1  C1  NDG A   1      72.354  19.046  10.329  1.00 20.00           C
HETATM    2  C2  NDG A   1      72.696  20.147  11.366  1.00 20.00           C
HETATM    3  C3  NDG A   1      72.987  19.557  12.755  1.00 20.00           C
HETATM    4  C4  NDG A   1      72.260  18.220  12.969  1.00 20.00           C
HETATM    5  C5  NDG A   1      70.961  18.152  12.153  1.00 20.00           C
HETATM    6  C6  NDG A   1      69.953  19.240  12.490  1.00 20.00           C
HETATM    7  C7  NDG A   1      74.312  21.932  11.648  1.00 20.00           C
HETATM    8  C8  NDG A   1      75.538  21.656  12.509  1.00 20.00           C
HETATM    9  O5  NDG A   1      71.223  18.223  10.721  1.00 20.00           O
HETATM   10  O3  NDG A   1      72.578  20.483  13.754  1.00 20.00           O
HETATM   11  O4  NDG A   1      73.111  17.141  12.603  1.00 20.00           O
HETATM   12  O6  NDG A   1      68.632  18.836  12.161  1.00 20.00           O
HETATM   13  O7  NDG A   1      73.803  23.055  11.651  1.00 20.00           O
HETATM   14  N2  NDG A   1      73.839  20.926  10.913  1.00 20.00           N
HETATM   15  O1  NDG A   1      73.449  18.223  10.087  1.00 20.00           O
HETATM   16  H1  NDG A   1      72.079  19.585   9.410  1.00 20.00           H
HETATM   17  H2  NDG A   1      71.815  20.800  11.455  1.00 20.00           H
HETATM   18  H3  NDG A   1      74.069  19.369  12.826  1.00 20.00           H
HETATM   19  H4  NDG A   1      72.001  18.143  14.035  1.00 20.00           H
HETATM   20  H5  NDG A   1      70.525  17.181  12.429  1.00 20.00           H
HETATM   21  H61 NDG A   1      70.003  19.450  13.569  1.00 20.00           H
HETATM   22  H62 NDG A   1      70.200  20.138  11.904  1.00 20.00           H
HETATM   23  H81 NDG A   1      76.429  21.589  11.868  1.00 20.00           H
HETATM   24  H82 NDG A   1      75.668  22.473  13.234  1.00 20.00           H
HETATM   25  H83 NDG A   1      75.402  20.706  13.047  1.00 20.00           H
HETATM   26  HO3 NDG A   1      72.487  20.033  14.586  1.00 20.00           H
HETATM   27  HO4 NDG A   1      73.301  17.188  11.673  1.00 20.00           H
HETATM   28  HO6 NDG A   1      68.121  18.746  12.956  1.00 20.00           H
HETATM   29  HN2 NDG A   1      74.274  20.704  10.041  1.00 20.00           H
HETATM   30  HO1 NDG A   1      73.505  18.035   9.157  1.00 20.00           H
CONECT    1    2    9   15   16
CONECT    2    3   14   17
CONECT    3    4   10   18
CONECT    4    5   11   19
CONECT    5    6    9   20
CONECT    6   12   21   22
CONECT    7    8   13   13   14
CONECT    8   23   24   25
CONECT   10   26
CONECT   11   27
CONECT   12   28
CONECT   14   29
CONECT   15   30
END