# generated using pymatgen
data_Cu3P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89606522
_cell_length_b   6.89606522
_cell_length_c   7.13933200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3P
_chemical_formula_sum   'Cu18 P6'
_cell_volume   294.02951734
_cell_formula_units_Z   6
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
  Cu  Cu0  1  0.00000000  0.61632790  0.92810515  1
  Cu  Cu1  1  0.38367210  0.00000000  0.42810515  1
  Cu  Cu2  1  0.61632790  0.61632790  0.42810515  1
  Cu  Cu3  1  0.38367210  0.38367210  0.92810515  1
  Cu  Cu4  1  0.61632790  0.00000000  0.92810515  1
  Cu  Cu5  1  0.00000000  0.38367210  0.42810515  1
  Cu  Cu6  1  0.66666667  0.33333333  0.68752894  1
  Cu  Cu7  1  0.33333333  0.66666667  0.18752894  1
  Cu  Cu8  1  0.66666667  0.33333333  0.18752894  1
  Cu  Cu9  1  0.33333333  0.66666667  0.68752894  1
  Cu  Cu10  1  0.00000000  0.00000000  0.82764697  1
  Cu  Cu11  1  0.00000000  0.00000000  0.32764697  1
  Cu  Cu12  1  0.00000000  0.27316472  0.07767096  1
  Cu  Cu13  1  0.72683528  0.00000000  0.57767096  1
  Cu  Cu14  1  0.27316472  0.27316472  0.57767096  1
  Cu  Cu15  1  0.72683528  0.72683528  0.07767096  1
  Cu  Cu16  1  0.27316472  0.00000000  0.07767096  1
  Cu  Cu17  1  0.00000000  0.72683528  0.57767096  1
  P  P18  1  0.00000000  0.33099832  0.75138927  1
  P  P19  1  0.66900168  0.00000000  0.25138927  1
  P  P20  1  0.33099832  0.33099832  0.25138927  1
  P  P21  1  0.66900168  0.66900168  0.75138927  1
  P  P22  1  0.33099832  0.00000000  0.75138927  1
  P  P23  1  0.00000000  0.66900168  0.25138927  1
