#
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
RHD      RHD 'RHODIUM HEXAMINE ION                ' non-polymer        25   7 M
#
data_comp_RHD
#
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
 RHD           RH     RH   .         3.000
 RHD           N1     N    .         0.000
 RHD           N2     N    .         0.000
 RHD           N3     N    .         0.000
 RHD           N4     N    .         0.000
 RHD           N5     N    .         0.000
 RHD           N6     N    .         0.000
 RHD           HN11   H    .         0.000
 RHD           HN12   H    .         0.000
 RHD           HN13   H    .         0.000
 RHD           HN21   H    .         0.000
 RHD           HN22   H    .         0.000
 RHD           HN23   H    .         0.000
 RHD           HN31   H    .         0.000
 RHD           HN32   H    .         0.000
 RHD           HN33   H    .         0.000
 RHD           HN41   H    .         0.000
 RHD           HN42   H    .         0.000
 RHD           HN43   H    .         0.000
 RHD           HN51   H    .         0.000
 RHD           HN52   H    .         0.000
 RHD           HN53   H    .         0.000
 RHD           HN61   H    .         0.000
 RHD           HN62   H    .         0.000
 RHD           HN63   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
 RHD        RH     N1        single
 RHD        RH     N2        single
 RHD        RH     N3        single
 RHD        RH     N4        single
 RHD        RH     N5        single
 RHD        RH     N6        single
 RHD        N1     HN11      single
 RHD        N1     HN12      single
 RHD        N1     HN13      single
 RHD        N2     HN21      single
 RHD        N2     HN22      single
 RHD        N2     HN23      single
 RHD        N3     HN31      single
 RHD        N3     HN32      single
 RHD        N3     HN33      single
 RHD        N4     HN41      single
 RHD        N4     HN42      single
 RHD        N4     HN43      single
 RHD        N5     HN51      single
 RHD        N5     HN52      single
 RHD        N5     HN53      single
 RHD        N6     HN61      single
 RHD        N6     HN62      single
 RHD        N6     HN63      single