HEADER    Model coordinates
 for PDB-CCD PEG
COMPND    PEG
AUTHOR    pdbccdutils 0.8.6
AUTHOR    RDKit 2023.09.6
HETATM    1  C1  PEG A   1      41.441  37.075  46.961  1.00 20.00           C
HETATM    2  O1  PEG A   1      41.169  36.262  45.821  1.00 20.00           O
HETATM    3  C2  PEG A   1      42.671  36.527  47.673  1.00 20.00           C
HETATM    4  O2  PEG A   1      42.583  35.973  49.017  1.00 20.00           O
HETATM    5  C3  PEG A   1      43.768  35.450  49.688  1.00 20.00           C
HETATM    6  C4  PEG A   1      43.382  34.037  50.091  1.00 20.00           C
HETATM    7  O4  PEG A   1      44.336  33.237  50.766  1.00 20.00           O
HETATM    8  H11 PEG A   1      41.630  38.110  46.640  1.00 20.00           H
HETATM    9  H12 PEG A   1      40.579  37.054  47.644  1.00 20.00           H
HETATM   10  HO1 PEG A   1      40.403  36.596  45.369  1.00 20.00           H
HETATM   11  H21 PEG A   1      43.071  35.727  47.032  1.00 20.00           H
HETATM   12  H22 PEG A   1      43.395  37.353  47.724  1.00 20.00           H
HETATM   13  H31 PEG A   1      44.629  35.438  49.004  1.00 20.00           H
HETATM   14  H32 PEG A   1      44.012  36.054  50.574  1.00 20.00           H
HETATM   15  H41 PEG A   1      42.503  34.116  50.748  1.00 20.00           H
HETATM   16  H42 PEG A   1      43.104  33.502  49.171  1.00 20.00           H
HETATM   17  HO4 PEG A   1      43.959  32.385  50.954  1.00 20.00           H
CONECT    1    2    3    8    9
CONECT    2   10
CONECT    3    4   11   12
CONECT    4    5
CONECT    5    6   13   14
CONECT    6    7   15   16
CONECT    7   17
END