data_image0
_chemical_formula_structural       AuSe2
_chemical_formula_sum              "Au1 Se2"
_cell_length_a       3.632440923900083
_cell_length_b       3.6324409239000826
_cell_length_c       18.072182163171803
_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  0.0  0.0  0.49999999991224625  1.0000
  Se  Se1       1.0  0.6666666657142603  0.33333333250220154  0.590274881787035  1.0000
  Se  Se2       1.0  0.6666666657142603  0.33333333250220154  0.409725118590794  1.0000