# generated using pymatgen
data_Cu2SiS3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.36413056
_cell_length_b   6.36413056
_cell_length_c   6.08898100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.59099168
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2SiS3
_chemical_formula_sum   'Cu4 Si2 S6'
_cell_volume   214.45126677
_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  0.32358400  0.00165200  0.98043000  1.0
  Cu  Cu1  1  0.67641600  0.99834800  0.48043000  1.0
  Cu  Cu2  1  0.99834800  0.67641600  0.48043000  1.0
  Cu  Cu3  1  0.00165200  0.32358400  0.98043000  1.0
  Si  Si4  1  0.66848800  0.66848800  0.01066400  1.0
  Si  Si5  1  0.33151200  0.33151200  0.51066400  1.0
  S  S6  1  0.33964600  0.01585800  0.60554100  1.0
  S  S7  1  0.66035400  0.98414200  0.10554100  1.0
  S  S8  1  0.34425000  0.34425000  0.13839500  1.0
  S  S9  1  0.65575000  0.65575000  0.63839500  1.0
  S  S10  1  0.01585800  0.33964600  0.60554100  1.0
  S  S11  1  0.98414200  0.66035400  0.10554100  1.0