data_image0
_chemical_formula_structural       AuSe2Au
_chemical_formula_sum              "Au2 Se2"
_cell_length_a       4.151308901776154
_cell_length_b       4.151308901776154
_cell_length_c       19.343822804395078
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    120.00000000000001

_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
  Au  Au1       1.0  0.333882977511442  0.6676907016492153  0.575707105188625  1.0000
  Se  Se1       1.0  0.6674615625672148  0.3348154245911976  0.38772067320095266  1.0000
  Se  Se2       1.0  0.00048093925968733565  0.0010776829587394012  0.6122793265718389  1.0000
  Au  Au2       1.0  0.3340680460360427  0.6682048848328163  0.42429689637847495  1.0000