# generated using pymatgen
data_YbY6FeBr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.08752673
_cell_length_b   9.08752750
_cell_length_c   9.08752747
_cell_angle_alpha   106.87454123
_cell_angle_beta   106.87453102
_cell_angle_gamma   106.87452312
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbY6FeBr12
_chemical_formula_sum   'Yb1 Y6 Fe1 Br12'
_cell_volume   627.13098702
_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
  Yb  Yb0  1  0.00000000  0.00000000  0.00000000  1.0
  Y  Y1  1  0.80825370  0.52410674  0.60186591  1.0
  Y  Y2  1  0.52410674  0.60186591  0.80825370  1.0
  Y  Y3  1  0.19174630  0.47589326  0.39813409  1.0
  Y  Y4  1  0.47589326  0.39813409  0.19174630  1.0
  Y  Y5  1  0.60186591  0.80825370  0.52410674  1.0
  Y  Y6  1  0.39813409  0.19174630  0.47589326  1.0
  Fe  Fe7  1  0.50000000  0.50000000  0.50000000  1.0
  Br  Br8  1  0.72351058  0.17779486  0.57311836  1.0
  Br  Br9  1  0.95921965  0.87927182  0.65751859  1.0
  Br  Br10  1  0.57311836  0.72351058  0.17779486  1.0
  Br  Br11  1  0.12072818  0.34248141  0.04078035  1.0
  Br  Br12  1  0.65751859  0.95921965  0.87927182  1.0
  Br  Br13  1  0.87927182  0.65751859  0.95921965  1.0
  Br  Br14  1  0.04078035  0.12072818  0.34248141  1.0
  Br  Br15  1  0.82220514  0.42688164  0.27648942  1.0
  Br  Br16  1  0.34248141  0.04078035  0.12072818  1.0
  Br  Br17  1  0.27648942  0.82220514  0.42688164  1.0
  Br  Br18  1  0.17779486  0.57311836  0.72351058  1.0
  Br  Br19  1  0.42688164  0.27648942  0.82220514  1.0