# generated using pymatgen
data_CsAuBr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81013100
_cell_length_b   7.81013192
_cell_length_c   7.95857072
_cell_angle_alpha   119.38490699
_cell_angle_beta   119.38490621
_cell_angle_gamma   89.99999244
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsAuBr3
_chemical_formula_sum   'Cs2 Au2 Br6'
_cell_volume   349.55602410
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Cs  Cs0  1  0.75000000  0.25000000  0.50000000  1.0
  Cs  Cs1  1  0.25000000  0.75000000  0.50000000  1.0
  Au  Au2  1  -0.00000000  -0.00000000  -0.00000000  1.0
  Au  Au3  1  0.50000000  0.50000000  -0.00000000  1.0
  Br  Br4  1  0.28690852  0.28690852  0.57381604  1.0
  Br  Br5  1  0.77455500  0.22544500  -0.00000000  1.0
  Br  Br6  1  0.71309148  0.71309148  0.42618396  1.0
  Br  Br7  1  0.22544500  0.22544500  -0.00000000  1.0
  Br  Br8  1  0.22544500  0.77455500  0.00000000  1.0
  Br  Br9  1  0.77455500  0.77455500  0.00000000  1.0