# generated using pymatgen
data_MgCu2O3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.23389500
_cell_length_b   4.06185900
_cell_length_c   9.45429000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu2O3
_chemical_formula_sum   'Mg2 Cu4 O6'
_cell_volume   124.18801291
_cell_formula_units_Z   2
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  0.61814400  0.50000000  0.50000000  1.0
  Mg  Mg1  1  0.38185600  0.00000000  0.00000000  1.0
  Cu  Cu2  1  0.83747600  0.50000000  0.83621100  1.0
  Cu  Cu3  1  0.83747600  0.50000000  0.16378900  1.0
  Cu  Cu4  1  0.16252400  0.00000000  0.66378900  1.0
  Cu  Cu5  1  0.16252400  0.00000000  0.33621100  1.0
  O  O6  1  0.10961400  0.50000000  0.34687900  1.0
  O  O7  1  0.10961400  0.50000000  0.65312100  1.0
  O  O8  1  0.89038600  0.00000000  0.15312100  1.0
  O  O9  1  0.49231900  0.50000000  0.00000000  1.0
  O  O10  1  0.50768100  0.00000000  0.50000000  1.0
  O  O11  1  0.89038600  0.00000000  0.84687900  1.0