# generated using pymatgen
data_TaCr3(CuS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.12130600
_cell_length_b   6.48873600
_cell_length_c   12.44371856
_cell_angle_alpha   81.24844218
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCr3(CuS4)2
_chemical_formula_sum   'Ta2 Cr6 Cu4 S16'
_cell_volume   568.30822230
_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
  Ta  Ta0  1  0.25000000  0.50743500  0.82201600  1.0
  Ta  Ta1  1  0.75000000  0.49256500  0.17798400  1.0
  Cr  Cr2  1  0.75000000  0.01219500  0.27311200  1.0
  Cr  Cr3  1  0.25000000  0.98780500  0.72688800  1.0
  Cr  Cr4  1  0.25000000  0.12109900  0.92946400  1.0
  Cr  Cr5  1  0.75000000  0.87890100  0.07053600  1.0
  Cr  Cr6  1  0.75000000  0.39231300  0.42966900  1.0
  Cr  Cr7  1  0.25000000  0.60768700  0.57033100  1.0
  Cu  Cu8  1  0.25000000  0.16536600  0.40363500  1.0
  Cu  Cu9  1  0.75000000  0.83463400  0.59636500  1.0
  Cu  Cu10  1  0.75000000  0.25618200  0.89646900  1.0
  Cu  Cu11  1  0.25000000  0.74381800  0.10353100  1.0
  S  S12  1  0.47759300  0.22069200  0.80763800  1.0
  S  S13  1  0.52240700  0.77930800  0.19236200  1.0
  S  S14  1  0.53597000  0.27330400  0.31663600  1.0
  S  S15  1  0.46403000  0.72669600  0.68336400  1.0
  S  S16  1  0.03597000  0.72669600  0.68336400  1.0
  S  S17  1  0.96403000  0.27330400  0.31663600  1.0
  S  S18  1  0.97759300  0.77930800  0.19236200  1.0
  S  S19  1  0.02240700  0.22069200  0.80763800  1.0
  S  S20  1  0.25000000  0.81589100  0.42331800  1.0
  S  S21  1  0.75000000  0.18410900  0.57668200  1.0
  S  S22  1  0.75000000  0.62886300  0.97360400  1.0
  S  S23  1  0.25000000  0.37113700  0.02639600  1.0
  S  S24  1  0.75000000  0.21068900  0.08008500  1.0
  S  S25  1  0.25000000  0.78931100  0.91991500  1.0
  S  S26  1  0.25000000  0.26591600  0.57139100  1.0
  S  S27  1  0.75000000  0.73408400  0.42860900  1.0