data_image0
_chemical_formula_structural       Ta2Ag2S6
_chemical_formula_sum              "Ta2 Ag2 S6"
_cell_length_a       6.517076723442805
_cell_length_b       6.51816086472511
_cell_length_c       4.607421
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.09924991663628

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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  Ta1       1.0  0.3331360661399673  0.6667201014993308  0.7500074336597415  1.0000
  Ta  Ta2       1.0  0.6668703954773142  0.3332857540803945  0.25000971259192506  1.0000
  Ag  Ag1       1.0  0.0  0.0  0.4999977210678165  1.0000
  Ag  Ag2       1.0  0.0  0.0  0.0  1.0000
  S   S1        1.0  0.3286374177920685  0.9146849020971699  0.25000971259192506  1.0000
  S   S2        1.0  0.0843101170173002  0.4125858716511995  0.25000971259192506  1.0000
  S   S3        1.0  0.5868033658285469  0.6708162426088301  0.25000971259192506  1.0000
  S   S4        1.0  0.6713601633439341  0.08530322060059695  0.7500074336597415  1.0000
  S   S5        1.0  0.9156963445999813  0.5874199839285258  0.7500074336597415  1.0000
  S   S6        1.0  0.4132030957887346  0.3291896129708952  0.7500074336597415  1.0000