# generated using pymatgen
data_ZnCuAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.14954400
_cell_length_b   5.93013600
_cell_length_c   8.45545900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCuAs
_chemical_formula_sum   'Zn4 Cu4 As4'
_cell_volume   208.06652576
_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
  Zn  Zn0  1  0.78143000  0.03173200  0.86666700  1.0
  Zn  Zn1  1  0.28143000  0.53173200  0.63333300  1.0
  Zn  Zn2  1  0.71857000  0.03173200  0.36666700  1.0
  Zn  Zn3  1  0.21857000  0.53173200  0.13333300  1.0
  Cu  Cu4  1  0.28216500  0.01978700  0.63726900  1.0
  Cu  Cu5  1  0.71783500  0.51978700  0.36273100  1.0
  Cu  Cu6  1  0.21783500  0.01978700  0.13726900  1.0
  Cu  Cu7  1  0.78216500  0.51978700  0.86273100  1.0
  As  As8  1  0.27690000  0.77654000  0.88645700  1.0
  As  As9  1  0.77690000  0.27654000  0.61354300  1.0
  As  As10  1  0.22310000  0.77654000  0.38645700  1.0
  As  As11  1  0.72310000  0.27654000  0.11354300  1.0