# generated using pymatgen
data_TlCu4S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85232464
_cell_length_b   3.85232464
_cell_length_c   9.39926588
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCu4S3
_chemical_formula_sum   'Tl1 Cu4 S3'
_cell_volume   139.48891360
_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
  Tl  Tl0  1  -0.00000000  -0.00000000  0.50000000  1.0
  Cu  Cu1  1  0.50000000  -0.00000000  0.15911689  1.0
  Cu  Cu2  1  0.50000000  0.00000000  0.84088311  1.0
  Cu  Cu3  1  -0.00000000  0.50000000  0.84088311  1.0
  Cu  Cu4  1  0.00000000  0.50000000  0.15911689  1.0
  S  S5  1  0.50000000  0.50000000  0.70947353  1.0
  S  S6  1  0.50000000  0.50000000  0.29052647  1.0
  S  S7  1  -0.00000000  -0.00000000  0.00000000  1.0