# generated using pymatgen
data_MgCu2(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.23670274
_cell_length_b   5.43792557
_cell_length_c   6.43982679
_cell_angle_alpha   77.94367653
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu2(O2F)2
_chemical_formula_sum   'Mg1 Cu2 O4 F2'
_cell_volume   110.84693516
_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  0.50000000  0.22084514  0.18889766  1.0
  Cu  Cu1  1  0.00000000  0.70153940  0.25463564  1.0
  Cu  Cu2  1  0.50000000  0.09301922  0.70263681  1.0
  O  O3  1  0.00000000  0.96346115  0.60359305  1.0
  O  O4  1  0.50000000  0.50619447  0.37462871  1.0
  O  O5  1  0.50000000  0.44286017  0.59774022  1.0
  O  O6  1  0.00000000  0.01722843  0.37219112  1.0
  F  F7  1  0.00000000  0.39570667  0.05137654  1.0
  F  F8  1  0.50000000  0.94452933  0.03138326  1.0