# generated using pymatgen
data_NaCu3O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04176400
_cell_length_b   6.04176400
_cell_length_c   8.79674800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCu3O4
_chemical_formula_sum   'Na4 Cu12 O16'
_cell_volume   321.10692017
_cell_formula_units_Z   4
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
  Na  Na0  1  0.24857300  0.50000000  0.75000000  1.0
  Na  Na1  1  0.50000000  0.24857300  0.00000000  1.0
  Na  Na2  1  0.50000000  0.75142700  0.50000000  1.0
  Na  Na3  1  0.75142700  0.50000000  0.25000000  1.0
  Cu  Cu4  1  0.00000000  0.24577800  0.00000000  1.0
  Cu  Cu5  1  0.00000000  0.75060300  0.00000000  1.0
  Cu  Cu6  1  0.00000000  0.24939700  0.50000000  1.0
  Cu  Cu7  1  0.00000000  0.75422200  0.50000000  1.0
  Cu  Cu8  1  0.24781300  0.50000000  0.25000000  1.0
  Cu  Cu9  1  0.24577800  0.00000000  0.75000000  1.0
  Cu  Cu10  1  0.24939700  0.00000000  0.25000000  1.0
  Cu  Cu11  1  0.50000000  0.24781300  0.50000000  1.0
  Cu  Cu12  1  0.50000000  0.75218700  0.00000000  1.0
  Cu  Cu13  1  0.75060300  0.00000000  0.75000000  1.0
  Cu  Cu14  1  0.75422200  0.00000000  0.25000000  1.0
  Cu  Cu15  1  0.75218700  0.50000000  0.75000000  1.0
  O  O16  1  0.97351800  0.22866500  0.78241900  1.0
  O  O17  1  0.97351800  0.77133500  0.71758100  1.0
  O  O18  1  0.22856300  0.52463800  0.02282200  1.0
  O  O19  1  0.22856300  0.47536200  0.47717800  1.0
  O  O20  1  0.22866500  0.97351800  0.96758100  1.0
  O  O21  1  0.22866500  0.02648200  0.53241900  1.0
  O  O22  1  0.52463800  0.22856300  0.72717800  1.0
  O  O23  1  0.52463800  0.77143700  0.77282200  1.0
  O  O24  1  0.47536200  0.22856300  0.27282200  1.0
  O  O25  1  0.47536200  0.77143700  0.22717800  1.0
  O  O26  1  0.77133500  0.02648200  0.46758100  1.0
  O  O27  1  0.77133500  0.97351800  0.03241900  1.0
  O  O28  1  0.77143700  0.52463800  0.97717800  1.0
  O  O29  1  0.77143700  0.47536200  0.52282200  1.0
  O  O30  1  0.02648200  0.22866500  0.21758100  1.0
  O  O31  1  0.02648200  0.77133500  0.28241900  1.0