#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
H4B      H4B '5,6,7,8-TETRAHYDROBIOPTERIN         ' non-polymer        32  17 M
#
data_comp_H4B
#
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.partial_charge
 H4B           N1     N    .         0.000
 H4B           C2     C    .         0.000
 H4B           N2     N    .         0.000
 H4B           N3     N    .         0.000
 H4B           C4     C    .         0.000
 H4B           O4     O    .         0.000
 H4B           C4A    C    .         0.000
 H4B           C8A    C    .         0.000
 H4B           N5     N    .         0.000
 H4B           N8     N    .         0.000
 H4B           C6     C    .         0.000
 H4B           C7     C    .         0.000
 H4B           C9     C    .         0.000
 H4B           O9     O    .         0.000
 H4B           C10    C    .         0.000
 H4B           C11    C    .         0.000
 H4B           O10    O    .         0.000
 H4B           HN21   H    .         0.000
 H4B           HN22   H    .         0.000
 H4B           HN3    H    .         0.000
 H4B           HN5    H    .         0.000
 H4B           HN8    H    .         0.000
 H4B           H6     H    .         0.000
 H4B           H71    H    .         0.000
 H4B           H72    H    .         0.000
 H4B           H9     H    .         0.000
 H4B           HO9    H    .         0.000
 H4B           H10    H    .         0.000
 H4B           H111   H    .         0.000
 H4B           H112   H    .         0.000
 H4B           H113   H    .         0.000
 H4B           HO0    H    .         0.000
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
 H4B        N1     C2        double
 H4B        N1     C8A       single
 H4B        C2     N2        single
 H4B        C2     N3        single
 H4B        N2     HN21      single
 H4B        N2     HN22      single
 H4B        N3     C4        single
 H4B        N3     HN3       single
 H4B        C4     O4        double
 H4B        C4     C4A       single
 H4B        C4A    C8A       double
 H4B        C4A    N5        single
 H4B        C8A    N8        single
 H4B        N5     C6        single
 H4B        N5     HN5       single
 H4B        N8     C7        single
 H4B        N8     HN8       single
 H4B        C6     C7        single
 H4B        C6     C9        single
 H4B        C6     H6        single
 H4B        C7     H71       single
 H4B        C7     H72       single
 H4B        C9     O9        single
 H4B        C9     C10       single
 H4B        C9     H9        single
 H4B        O9     HO9       single
 H4B        C10    C11       single
 H4B        C10    O10       single
 H4B        C10    H10       single
 H4B        C11    H111      single
 H4B        C11    H112      single
 H4B        C11    H113      single
 H4B        O10    HO0       single