# generated using pymatgen
data_TiCrCuS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44633200
_cell_length_b   5.91474100
_cell_length_c   11.51215628
_cell_angle_alpha   89.24582629
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCrCuS4
_chemical_formula_sum   'Ti2 Cr2 Cu2 S8'
_cell_volume   234.64532042
_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
  Ti  Ti0  1  0.50000000  0.53074900  0.25531700  1.0
  Ti  Ti1  1  0.50000000  0.46925100  0.74468300  1.0
  Cr  Cr2  1  0.00000000  0.01953100  0.75651300  1.0
  Cr  Cr3  1  0.00000000  0.98046900  0.24348700  1.0
  Cu  Cu4  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu5  1  0.00000000  0.00000000  0.50000000  1.0
  S  S6  1  0.50000000  0.16483400  0.87771300  1.0
  S  S7  1  0.50000000  0.83516600  0.12228700  1.0
  S  S8  1  0.00000000  0.66921800  0.38138000  1.0
  S  S9  1  0.00000000  0.33078200  0.61862000  1.0
  S  S10  1  0.00000000  0.66609300  0.86445500  1.0
  S  S11  1  0.00000000  0.33390700  0.13554500  1.0
  S  S12  1  0.50000000  0.15438300  0.36008500  1.0
  S  S13  1  0.50000000  0.84561700  0.63991500  1.0