# generated using pymatgen
data_Cu3As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29057071
_cell_length_b   8.29057040
_cell_length_c   8.29057098
_cell_angle_alpha   109.47122453
_cell_angle_beta   109.47122379
_cell_angle_gamma   109.47121825
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3As
_chemical_formula_sum   'Cu24 As8'
_cell_volume   438.66336455
_cell_formula_units_Z   8
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  0.69952546  0.35080203  0.78608281  1.0
  Cu  Cu1  1  0.14919797  0.84872343  0.43527878  1.0
  Cu  Cu2  1  0.71391719  0.06472122  0.91344265  1.0
  Cu  Cu3  1  0.80047454  0.58655735  0.65127657  1.0
  Cu  Cu4  1  0.58655735  0.65127657  0.80047454  1.0
  Cu  Cu5  1  0.65127657  0.80047454  0.58655735  1.0
  Cu  Cu6  1  0.19952546  0.28608281  0.85080203  1.0
  Cu  Cu7  1  0.93527978  0.34872343  0.64919797  1.0
  Cu  Cu8  1  0.30047454  0.15127657  0.08655735  1.0
  Cu  Cu9  1  0.84872343  0.43527878  0.14919797  1.0
  Cu  Cu10  1  0.78608281  0.69952546  0.35080203  1.0
  Cu  Cu11  1  0.35080203  0.78608281  0.69952546  1.0
  Cu  Cu12  1  0.91344265  0.71391719  0.06472122  1.0
  Cu  Cu13  1  0.06472122  0.91344265  0.71391719  1.0
  Cu  Cu14  1  0.43527878  0.14919797  0.84872343  1.0
  Cu  Cu15  1  0.21391719  0.41344265  0.56472022  1.0
  Cu  Cu16  1  0.64919797  0.93527978  0.34872343  1.0
  Cu  Cu17  1  0.28608281  0.85080203  0.19952546  1.0
  Cu  Cu18  1  0.41344265  0.56472022  0.21391719  1.0
  Cu  Cu19  1  0.34872343  0.64919797  0.93527978  1.0
  Cu  Cu20  1  0.85080203  0.19952546  0.28608281  1.0
  Cu  Cu21  1  0.08655735  0.30047454  0.15127657  1.0
  Cu  Cu22  1  0.15127657  0.08655735  0.30047454  1.0
  Cu  Cu23  1  0.56472022  0.21391719  0.41344265  1.0
  As  As24  1  0.43337826  0.43337826  0.43337826  1.0
  As  As25  1  0.56662174  0.50000000  0.00000000  1.0
  As  As26  1  0.50000000  0.00000000  0.56662174  1.0
  As  As27  1  0.00000000  0.56662174  0.50000000  1.0
  As  As28  1  0.50000000  0.00000000  0.06662174  1.0
  As  As29  1  0.00000000  0.06662174  0.50000000  1.0
  As  As30  1  0.06662174  0.50000000  0.00000000  1.0
  As  As31  1  0.93337826  0.93337826  0.93337826  1.0