#
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
RMN      RMN '(R)-MANDELIC ACID                   ' non-polymer        19  11 M
#
data_comp_RMN
#
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
 RMN           C1     C    .         0.000
 RMN           C2     C    .         0.000
 RMN           C3     C    .         0.000
 RMN           C4     C    .         0.000
 RMN           C5     C    .         0.000
 RMN           C6     C    .         0.000
 RMN           C7     C    .         0.000
 RMN           C10    C    .         0.000
 RMN           O8     O    .         0.000
 RMN           O11    O    .         0.000
 RMN           O12    O    .         0.000
 RMN           H2     H    .         0.000
 RMN           H3     H    .         0.000
 RMN           H4     H    .         0.000
 RMN           H5     H    .         0.000
 RMN           H6     H    .         0.000
 RMN           H7     H    .         0.000
 RMN           HO8    H    .         0.000
 RMN           HO2    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
 RMN        C1     C2        double
 RMN        C1     C6        single
 RMN        C1     C7        single
 RMN        C2     C3        single
 RMN        C2     H2        single
 RMN        C3     C4        double
 RMN        C3     H3        single
 RMN        C4     C5        single
 RMN        C4     H4        single
 RMN        C5     C6        double
 RMN        C5     H5        single
 RMN        C6     H6        single
 RMN        C7     C10       single
 RMN        C7     O8        single
 RMN        C7     H7        single
 RMN        C10    O11       double
 RMN        C10    O12       single
 RMN        O8     HO8       single
 RMN        O12    HO2       single