data_image0
_chemical_formula_structural       HfMoHfMoS8
_chemical_formula_sum              "Hf2 Mo2 S8"
_cell_length_a       6.889597721875051
_cell_length_b       6.84966389411888
_cell_length_c       33.19
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    119.85156710710639

_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
  Hf  Hf1       1.0  0.4999999999999991  0.9999999999999978  0.5  1.0000
  Mo  Mo1       1.0  0.9999999999999999  0.9999999999999997  0.5  1.0000
  Hf  Hf2       1.0  0.49999999999999994  0.49999999999999983  0.5  1.0000
  Mo  Mo2       1.0  0.9999999999999999  0.49999999999999983  0.5  1.0000
  S   S1        1.0  0.3235216842306715  0.161763082167412  0.5460426464926014  1.0000
  S   S2        1.0  0.8439107716387829  0.17195856589659714  0.5449972055814398  1.0000
  S   S3        1.0  0.3235216825321839  0.6617630808519763  0.5460426468236669  1.0000
  S   S4        1.0  0.8439107720690363  0.6719585663255916  0.5449972055743556  1.0000
  S   S5        1.0  0.15608922793096355  0.32804143367440647  0.45500279442564445  1.0000
  S   S6        1.0  0.6764783174678156  0.3382369191480223  0.4539573531763331  1.0000
  S   S7        1.0  0.15608922836121678  0.8280414341034023  0.4550027944185601  1.0000
  S   S8        1.0  0.6764783157693283  0.8382369178325869  0.45395735350739863  1.0000