# generated using pymatgen
data_MgFe4(CuO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53187987
_cell_length_b   6.53187893
_cell_length_c   6.01676024
_cell_angle_alpha   56.46201234
_cell_angle_beta   56.46200892
_cell_angle_gamma   54.59223843
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgFe4(CuO4)2
_chemical_formula_sum   'Mg1 Fe4 Cu2 O8'
_cell_volume   163.87694500
_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  0.12500000  0.12500000  0.12500000  1.0
  Fe  Fe1  1  0.99505100  0.99505100  0.91844400  1.0
  Fe  Fe2  1  0.25494900  0.25494900  0.33155600  1.0
  Fe  Fe3  1  0.12500000  0.62500000  0.62500000  1.0
  Fe  Fe4  1  0.62500000  0.12500000  0.62500000  1.0
  Cu  Cu5  1  0.62500000  0.62500000  0.12500000  1.0
  Cu  Cu6  1  0.62500000  0.62500000  0.62500000  1.0
  O  O7  1  0.40768700  0.40768700  0.37001300  1.0
  O  O8  1  0.33435800  0.87537400  0.41825800  1.0
  O  O9  1  0.34527900  0.34527900  0.90115300  1.0
  O  O10  1  0.87537400  0.33435800  0.41825800  1.0
  O  O11  1  0.37462600  0.91564200  0.83174200  1.0
  O  O12  1  0.91564200  0.37462600  0.83174200  1.0
  O  O13  1  0.90472100  0.90472100  0.34884700  1.0
  O  O14  1  0.84231300  0.84231300  0.87998700  1.0