# generated using pymatgen
data_TcBiS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.35516931
_cell_length_b   7.35517009
_cell_length_c   7.35516928
_cell_angle_alpha   60.00000363
_cell_angle_beta   60.00000015
_cell_angle_gamma   59.99999849
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcBiS
_chemical_formula_sum   'Tc4 Bi4 S4'
_cell_volume   281.36046737
_cell_formula_units_Z   4
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
  Tc  Tc0  1  0.15819439  0.15819439  0.15819439  1.0
  Tc  Tc1  1  0.52541682  0.15819439  0.15819439  1.0
  Tc  Tc2  1  0.15819439  0.15819439  0.52541682  1.0
  Tc  Tc3  1  0.15819439  0.52541682  0.15819439  1.0
  Bi  Bi4  1  0.88453470  0.34639390  0.88453470  1.0
  Bi  Bi5  1  0.88453470  0.88453470  0.34639390  1.0
  Bi  Bi6  1  0.34639390  0.88453470  0.88453470  1.0
  Bi  Bi7  1  0.88453470  0.88453470  0.88453470  1.0
  S  S8  1  0.37451705  0.37451705  0.37451705  1.0
  S  S9  1  0.87645185  0.37451705  0.37451705  1.0
  S  S10  1  0.37451705  0.37451705  0.87645185  1.0
  S  S11  1  0.37451705  0.87645185  0.37451705  1.0