#
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
3MF      3MF '3-O-METHYLFRUCTOSE IN LINEAR FORM   ' non-polymer        27  13 M
#
data_comp_3MF
#
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
 3MF           C1     C    .         0.000
 3MF           C2     C    .         0.000
 3MF           C3     C    .         0.000
 3MF           C4     C    .         0.000
 3MF           C5     C    .         0.000
 3MF           C6     C    .         0.000
 3MF           C7     C    .         0.000
 3MF           O1     O    .         0.000
 3MF           O2     O    .         0.000
 3MF           O3     O    .         0.000
 3MF           O4     O    .         0.000
 3MF           O5     O    .         0.000
 3MF           O6     O    .         0.000
 3MF           H11    H    .         0.000
 3MF           H12    H    .         0.000
 3MF           H3     H    .         0.000
 3MF           H4     H    .         0.000
 3MF           H5     H    .         0.000
 3MF           H61    H    .         0.000
 3MF           H62    H    .         0.000
 3MF           H71    H    .         0.000
 3MF           H72    H    .         0.000
 3MF           H73    H    .         0.000
 3MF           HO1    H    .         0.000
 3MF           HO4    H    .         0.000
 3MF           HO5    H    .         0.000
 3MF           HO6    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
 3MF        C1     C2        single
 3MF        C1     O1        single
 3MF        C1     H11       single
 3MF        C1     H12       single
 3MF        C2     C3        single
 3MF        C2     O2        double
 3MF        C3     C4        single
 3MF        C3     O3        single
 3MF        C3     H3        single
 3MF        C4     C5        single
 3MF        C4     O4        single
 3MF        C4     H4        single
 3MF        C5     C6        single
 3MF        C5     O5        single
 3MF        C5     H5        single
 3MF        C6     O6        single
 3MF        C6     H61       single
 3MF        C6     H62       single
 3MF        C7     O3        single
 3MF        C7     H71       single
 3MF        C7     H72       single
 3MF        C7     H73       single
 3MF        O1     HO1       single
 3MF        O4     HO4       single
 3MF        O5     HO5       single
 3MF        O6     HO6       single