data_YBiBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.79
_cell_length_b   6.79
_cell_length_c   6.76
_cell_angle_alpha   119.06
_cell_angle_beta   119.06
_cell_angle_gamma   30.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YBiBr2
_chemical_formula_sum   'Y1 Bi1 Br2'
_cell_volume   137.28
_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
  Y  Y3  1  0.17  0.0  0.9  1.0
  Bi  Bi0  1  0.84  0.0  0.45  1.0
  Br  Br1  1  0.93  0.0  0.19  1.0
  Br  Br2  1  0.6  0.0  0.21  1.0

data_YBiBr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.59
_cell_length_b   6.76
_cell_length_c   6.79
_cell_angle_alpha   119.06
_cell_angle_beta   105.34
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YBiBr2
_chemical_formula_sum   'Y1 Bi1 Br2'
_cell_volume   137.28
_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
  Y  Y0  1  0.0  0.9  0.17  1.0
  Bi  Bi1  1  0.0  0.45  0.84  1.0
  Br  Br2  1  0.0  0.19  0.93  1.0
  Br  Br3  1  0.0  0.21  0.6  1.0

Y Bi Br Br