data_image0
_chemical_formula_structural       TaS2TaS2TaS2TaS2TaS2TaS2Ta3
_chemical_formula_sum              "Ta9 S12"
_cell_length_a       5.69042946497502
_cell_length_b       5.690658766167403
_cell_length_c       24.82141934264215
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    60.00145344666972

_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  3.558186388739713e-06  0.9999518332020958  0.36574181696386643  1.0000
  S   S1        1.0  8.228987876702344e-06  0.33326229783828565  0.43219875994641915  1.0000
  S   S2        1.0  2.6753665033595778e-05  0.3333021217015569  0.30194987105850984  1.0000
  Ta  Ta2       1.0  2.697471911554926e-05  0.9999865360479099  0.6342425698015799  1.0000
  S   S3        1.0  0.6666659317970537  0.3333355919348534  0.5677900210077114  1.0000
  S   S4        1.0  0.6667343694970779  0.3332815548808771  0.6980495482880653  1.0000
  Ta  Ta3       1.0  0.3333404252456465  0.3332991511256731  0.3657507225786884  1.0000
  S   S5        1.0  0.333322430303951  0.6666433295865829  0.43221008564847185  1.0000
  S   S6        1.0  0.3333545251691  0.6666176700000193  0.30194972642536255  1.0000
  Ta  Ta4       1.0  0.33339324997463937  0.33328443920296535  0.6342509109845373  1.0000
  S   S7        1.0  4.240263702489627e-05  0.6666126409194206  0.5677957700745971  1.0000
  S   S8        1.0  7.82487249797184e-05  0.6666474790050789  0.6980429197388381  1.0000
  Ta  Ta5       1.0  0.6666746769057079  0.6666123649839147  0.3657489007650614  1.0000
  S   S9        1.0  0.6666812077267535  0.999953336467834  0.43220197410588757  1.0000
  S   S10       1.0  0.6666448465379019  0.9999631290942843  0.3019518435484519  1.0000
  Ta  Ta6       1.0  0.6667176246614426  0.6666285577909546  0.6342543036188922  1.0000
  S   S11       1.0  0.33339036872040717  0.9999389578305674  0.5677929656418997  1.0000
  S   S12       1.0  0.333352649763982  0.9999693120092595  0.6980451448331907  1.0000
  Ta  Ta7       1.0  0.9999853967236967  0.9999812579566154  0.5000023495303842  1.0000
  Ta  Ta8       1.0  0.6667286101130531  0.6666153141969066  0.49999585352796894  1.0000
  Ta  Ta9       1.0  0.3333244533378688  0.3332689331939203  0.4999965907944301  1.0000