# generated using pymatgen
data_FeCu2SnS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.60796537
_cell_length_b   6.60796537
_cell_length_c   6.60796537
_cell_angle_alpha   131.11712933
_cell_angle_beta   131.11712933
_cell_angle_gamma   71.62705110
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCu2SnS4
_chemical_formula_sum   'Fe1 Cu2 Sn1 S4'
_cell_volume   160.23133705
_cell_formula_units_Z   1
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
  Fe  Fe0  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.75000000  0.25000000  0.50000000  1.0
  Cu  Cu2  1  0.25000000  0.75000000  0.50000000  1.0
  Sn  Sn3  1  0.50000000  0.50000000  0.00000000  1.0
  S  S4  1  0.10056500  0.10056500  0.46573800  1.0
  S  S5  1  0.89943500  0.36517300  0.00000000  1.0
  S  S6  1  0.36517300  0.89943500  0.00000000  1.0
  S  S7  1  0.63482700  0.63482700  0.53426200  1.0