data_image0
_chemical_formula_structural       CrHfCrHfS8
_chemical_formula_sum              "Cr2 Hf2 S8"
_cell_length_a       6.873706381704352
_cell_length_b       7.0205050986839215
_cell_length_c       33.19
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.70610812506689

_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
  Cr  Cr1       1.0  0.5000000000000002  2.220446049250313e-16  0.5  1.0000
  Hf  Hf1       1.0  8.881784197001252e-16  1.1102230246251565e-15  0.5  1.0000
  Cr  Cr2       1.0  0.5000000000000004  0.5000000000000004  0.5  1.0000
  Hf  Hf2       1.0  0.9999999999999997  0.5  0.5  1.0000
  S   S1        1.0  0.3548460321669477  0.17739661554790487  0.5420069397515995  1.0000
  S   S2        1.0  0.8200705712128429  0.1600257814688482  0.5446587583013558  1.0000
  S   S3        1.0  0.35484603225395367  0.6773966156034444  0.542006939736361  1.0000
  S   S4        1.0  0.8200705711987325  0.6600257814765644  0.544658758300314  1.0000
  S   S5        1.0  0.17992942880126814  0.33997421852343607  0.455341241699686  1.0000
  S   S6        1.0  0.6451539677460473  0.32260338439655584  0.45799306026363845  1.0000
  S   S7        1.0  0.17992942878715731  0.8399742185311514  0.45534124169864393  1.0000
  S   S8        1.0  0.6451539678330531  0.8226033844520959  0.45799306024840014  1.0000