# generated using pymatgen
data_Ta6Nb3Te2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43973300
_cell_length_b   12.35887900
_cell_length_c   13.65327096
_cell_angle_alpha   67.39300955
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta6Nb3Te2S3
_chemical_formula_sum   'Ta12 Nb6 Te4 S6'
_cell_volume   535.82017835
_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  0.66735400  0.71886700  1.0
  Ta  Ta1  1  0.75000000  0.33264600  0.28113300  1.0
  Ta  Ta2  1  0.25000000  0.24909200  0.81150200  1.0
  Ta  Ta3  1  0.75000000  0.75090800  0.18849800  1.0
  Ta  Ta4  1  0.25000000  0.47998200  0.59153800  1.0
  Ta  Ta5  1  0.75000000  0.52001800  0.40846200  1.0
  Ta  Ta6  1  0.25000000  0.54643300  0.23402200  1.0
  Ta  Ta7  1  0.75000000  0.45356700  0.76597800  1.0
  Ta  Ta8  1  0.25000000  0.71801300  0.36398700  1.0
  Ta  Ta9  1  0.75000000  0.28198700  0.63601300  1.0
  Ta  Ta10  1  0.25000000  0.32264500  0.45272900  1.0
  Ta  Ta11  1  0.75000000  0.67735500  0.54727100  1.0
  Nb  Nb12  1  0.25000000  0.09374400  0.41101200  1.0
  Nb  Nb13  1  0.75000000  0.90625600  0.58898800  1.0
  Nb  Nb14  1  0.25000000  0.44371000  0.93875700  1.0
  Nb  Nb15  1  0.75000000  0.55629000  0.06124300  1.0
  Nb  Nb16  1  0.25000000  0.07925700  0.65490900  1.0
  Nb  Nb17  1  0.75000000  0.92074300  0.34509100  1.0
  Te  Te18  1  0.25000000  0.94730100  0.16302500  1.0
  Te  Te19  1  0.75000000  0.05269900  0.83697500  1.0
  Te  Te20  1  0.25000000  0.75717300  0.01666200  1.0
  Te  Te21  1  0.75000000  0.24282700  0.98333800  1.0
  S  S22  1  0.25000000  0.83943300  0.48739100  1.0
  S  S23  1  0.75000000  0.16056700  0.51260900  1.0
  S  S24  1  0.25000000  0.39293400  0.13630700  1.0
  S  S25  1  0.75000000  0.60706600  0.86369300  1.0
  S  S26  1  0.25000000  0.86105200  0.73456100  1.0
  S  S27  1  0.75000000  0.13894800  0.26543900  1.0