data_image0
_chemical_formula_structural       BrAg
_chemical_formula_sum              "Br1 Ag1"
_cell_length_a       4.517944433651963
_cell_length_b       4.518239706987851
_cell_length_c       30.0
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    119.99783821630145

_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
  Br  Br1       1.0  3.6672670923395116e-06  7.334534184679027e-06  0.5  1.0000
  Ag  Ag1       1.0  0.6666963317267919  0.333392662048512  0.5  1.0000