# generated using pymatgen
data_Ta5Mn2MoS12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.75693336
_cell_length_b   5.75693250
_cell_length_c   12.69692482
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001058
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta5Mn2MoS12
_chemical_formula_sum   'Ta5 Mn2 Mo1 S12'
_cell_volume   364.42777799
_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
  Ta  Ta0  1  0.00000000  0.00000000  0.50000000  1.0
  Ta  Ta1  1  0.33333300  0.66666700  0.50077983  1.0
  Ta  Ta2  1  0.66666700  0.33333300  0.00072226  1.0
  Ta  Ta3  1  0.66666700  0.33333300  0.49922017  1.0
  Ta  Ta4  1  0.33333300  0.66666700  0.99927774  1.0
  Mn  Mn5  1  0.33333300  0.66666700  0.25186719  1.0
  Mn  Mn6  1  0.66666700  0.33333300  0.74813281  1.0
  Mo  Mo7  1  0.00000000  0.00000000  0.00000000  1.0
  S  S8  1  0.32998302  0.00191084  0.12201125  1.0
  S  S9  1  0.99808916  0.32807018  0.12201125  1.0
  S  S10  1  0.66706163  0.99683536  0.62314813  1.0
  S  S11  1  0.00191084  0.32998302  0.87798875  1.0
  S  S12  1  0.67192982  0.67001698  0.12201125  1.0
  S  S13  1  0.00316464  0.67022627  0.62314813  1.0
  S  S14  1  0.32807018  0.99808916  0.87798875  1.0
  S  S15  1  0.99683536  0.66706163  0.37685187  1.0
  S  S16  1  0.32977373  0.33293837  0.62314813  1.0
  S  S17  1  0.67022627  0.00316464  0.37685187  1.0
  S  S18  1  0.67001698  0.67192982  0.87798875  1.0
  S  S19  1  0.33293837  0.32977373  0.37685187  1.0