data_image0
_chemical_formula_structural       Ag2Se2Br2
_chemical_formula_sum              "Ag2 Se2 Br2"
_cell_length_a       4.291521845821172
_cell_length_b       3.7508154159512084
_cell_length_c       21.341805962036666
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_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
  Ag  Ag1       1.0  0.4999999993217823  1.409564646099183e-18  0.3922357988302667  1.0000
  Ag  Ag2       1.0  2.7961255448837742e-18  0.5000000005397215  0.607764528600474  1.0000
  Se  Se1       1.0  0.4999999993217823  0.5000000005397215  0.48014272073449726  1.0000
  Se  Se2       1.0  3.663702121228943e-18  1.0328449981855674e-35  0.5198564718344588  1.0000
  Br  Br1       1.0  0.4999999993217823  0.5000000005397215  0.30870461861191395  1.0000
  Br  Br2       1.0  4.8719252483815654e-18  1.373458719574335e-35  0.6912957950345858  1.0000