global_
_lib_name         ?
_lib_version      ?
_lib_update       ?
# ------------------------------------------------
#
# ---   LIST OF MONOMERS ---
#
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
MF4      MF4 'TETRAFLUOROMAGNESATE(2-)            ' non-polymer         5   5 .
# ------------------------------------------------------
# ------------------------------------------------------
#
# --- DESCRIPTION OF MONOMERS ---
#
data_comp_MF4
#
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
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 MF4           F4     F    F         0.000      0.000    0.000    0.000
 MF4           MG     MG   MG       -2.000     -1.748    0.000   -0.387
 MF4           F1     F    F         0.000     -2.147   -1.462   -1.339
 MF4           F2     F    F         0.000     -2.147    1.462   -1.339
 MF4           F3     F    F         0.000     -2.696    0.000    1.131
loop_
_chem_comp_tree.comp_id
_chem_comp_tree.atom_id
_chem_comp_tree.atom_back
_chem_comp_tree.atom_forward
_chem_comp_tree.connect_type
 MF4      F4     n/a    MG     START
 MF4      MG     F4     F3     .
 MF4      F1     MG     .      .
 MF4      F2     MG     .      .
 MF4      F3     MG     .      END
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
 MF4      F1     MG        single      1.985    0.020
 MF4      F2     MG        single      1.985    0.020
 MF4      F3     MG        single      1.985    0.020
 MF4      MG     F4        single      1.985    0.020
loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 MF4      F4     MG     F1       90.000    3.000
 MF4      F4     MG     F2       90.000    3.000
 MF4      F4     MG     F3       90.000    3.000
 MF4      F1     MG     F2       90.000    3.000
 MF4      F1     MG     F3       90.000    3.000
 MF4      F2     MG     F3       90.000    3.000
loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
 MF4      chir_01  MG     F4     F1     F2        both
# ------------------------------------------------------
