# generated using pymatgen
data_Cs2CuBrCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.24980490
_cell_length_b   9.24980490
_cell_length_c   9.24980490
_cell_angle_alpha   147.71076733
_cell_angle_beta   147.71076733
_cell_angle_gamma   46.31251540
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs2CuBrCl3
_chemical_formula_sum   'Cs2 Cu1 Br1 Cl3'
_cell_volume   225.04257809
_cell_formula_units_Z   1
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  0.63688700  0.63688700  0.00000000  1.0
  Cs  Cs1  1  0.36431300  0.36431300  0.00000000  1.0
  Cu  Cu2  1  0.99658300  0.99658300  0.00000000  1.0
  Br  Br3  1  0.14496900  0.14496900  0.00000000  1.0
  Cl  Cl4  1  0.49905200  0.99905200  0.50000000  1.0
  Cl  Cl5  1  0.99905200  0.49905200  0.50000000  1.0
  Cl  Cl6  1  0.85914500  0.85914500  0.00000000  1.0