# generated using pymatgen
data_Co2CuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82890592
_cell_length_b   5.82890592
_cell_length_c   5.82890592
_cell_angle_alpha   59.95148336
_cell_angle_beta   90.30832832
_cell_angle_gamma   120.30799982
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2CuO4
_chemical_formula_sum   'Co4 Cu2 O8'
_cell_volume   139.65766992
_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
  Co  Co0  1  0.00449900  0.00000000  0.99550100  1.0
  Co  Co1  1  0.62500000  0.25000000  0.62500000  1.0
  Co  Co2  1  0.24550100  0.50000000  0.25449900  1.0
  Co  Co3  1  0.12500000  0.75000000  0.62500000  1.0
  Cu  Cu4  1  0.62500000  0.25000000  0.12500000  1.0
  Cu  Cu5  1  0.62500000  0.75000000  0.62500000  1.0
  O  O6  1  0.83947400  0.23263000  0.39315700  1.0
  O  O7  1  0.37965300  0.22107100  0.39927600  1.0
  O  O8  1  0.87034700  0.27892900  0.85072400  1.0
  O  O9  1  0.87034700  0.72107100  0.40858200  1.0
  O  O10  1  0.87578800  0.73263000  0.85684300  1.0
  O  O11  1  0.41052600  0.26737000  0.85684300  1.0
  O  O12  1  0.37421200  0.76737000  0.39315700  1.0
  O  O13  1  0.37965300  0.77892900  0.84141800  1.0