# generated using pymatgen
data_Cu3AsS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12100792
_cell_length_b   6.39787561
_cell_length_c   7.36478541
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3AsS4
_chemical_formula_sum   'Cu6 As2 S8'
_cell_volume   288.41565556
_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
  Cu  Cu0  1  0.99595289  0.83961159  0.50000000  1.0
  Cu  Cu1  1  0.49253929  0.67060778  0.74996110  1.0
  Cu  Cu2  1  0.49253929  0.67060778  0.25003890  1.0
  Cu  Cu3  1  0.99253929  0.32939222  0.24996110  1.0
  Cu  Cu4  1  0.49595289  0.16038841  0.00000000  1.0
  Cu  Cu5  1  0.99253929  0.32939222  0.75003890  1.0
  As  As6  1  0.49847158  0.16969132  0.50000000  1.0
  As  As7  1  0.99847158  0.83030868  0.00000000  1.0
  S  S8  1  0.62224757  0.33689004  0.74886877  1.0
  S  S9  1  0.12224757  0.66310996  0.75113123  1.0
  S  S10  1  0.12224757  0.66310996  0.24886877  1.0
  S  S11  1  0.62224757  0.33689004  0.25113123  1.0
  S  S12  1  0.62399264  0.84185560  0.50000000  1.0
  S  S13  1  0.12399264  0.15814440  0.00000000  1.0
  S  S14  1  0.63212616  0.82761881  0.00000000  1.0
  S  S15  1  0.13212616  0.17238119  0.50000000  1.0