# generated using pymatgen
data_MgCu2(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.34060122
_cell_length_b   5.17320813
_cell_length_c   6.61365731
_cell_angle_alpha   113.13486852
_cell_angle_beta   104.62863576
_cell_angle_gamma   90.00002406
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu2(O2F)2
_chemical_formula_sum   'Mg1 Cu2 O4 F2'
_cell_volume   101.06195997
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Mg  Mg0  1  0.50003300  0.14889300  0.00006700  1.0
  Cu  Cu1  1  0.84750500  0.48349100  0.69501000  1.0
  Cu  Cu2  1  0.15265200  0.78874500  0.30530200  1.0
  O  O3  1  0.06575000  0.37947200  0.13150000  1.0
  O  O4  1  0.93405200  0.24804200  0.86810500  1.0
  O  O5  1  0.43651400  0.71338500  0.87302600  1.0
  O  O6  1  0.56334800  0.84046500  0.12669800  1.0
  F  F7  1  0.74955800  0.69291700  0.49911700  1.0
  F  F8  1  0.25058800  0.19447200  0.50117500  1.0