data_Yb4Br6O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.47
_cell_length_b   9.47
_cell_length_c   7.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Yb4Br6O
_chemical_formula_sum   'Yb8 Br12 O2'
_cell_volume   557.92
_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
  Yb  Yb0  1  0.73  0.86  0.61  1.0
  Yb  Yb1  1  0.73  0.73  0.54  1.0
  Yb  Yb2  1  0.89  0.67  0.61  1.0
  Yb  Yb3  1  0.58  0.67  0.61  1.0
  Yb  Yb4  1  0.16  0.53  0.02  1.0
  Yb  Yb5  1  0.0  0.47  0.95  1.0
  Yb  Yb6  1  0.84  0.53  0.02  1.0
  Yb  Yb7  1  0.0  0.34  0.02  1.0
  Br  Br8  1  0.73  0.94  0.36  1.0
  Br  Br9  1  0.87  0.81  0.48  1.0
  Br  Br10  1  0.96  0.13  0.36  1.0
  Br  Br11  1  0.6  0.81  0.48  1.0
  Br  Br12  1  0.73  0.58  0.48  1.0
  Br  Br13  1  0.22  0.07  0.76  1.0
  Br  Br14  1  0.51  0.13  0.36  1.0
  Br  Br15  1  0.0  0.62  0.07  1.0
  Br  Br16  1  0.78  0.07  0.76  1.0
  Br  Br17  1  0.13  0.39  0.07  1.0
  Br  Br18  1  0.87  0.39  0.07  1.0
  Br  Br19  1  0.0  0.26  0.76  1.0
  O  O20  1  0.73  0.73  0.32  1.0
  O  O21  1  0.0  0.47  0.72  1.0

data_Yb4Br6O
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.19
_cell_length_b   9.47
_cell_length_c   9.47
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Yb4Br6O
_chemical_formula_sum   'Yb8 Br12 O2'
_cell_volume   557.92
_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
  Yb  Yb0  1  0.02  -0.0  0.34  1.0
  Yb  Yb1  1  0.02  0.16  0.53  1.0
  Yb  Yb2  1  0.02  0.84  0.53  1.0
  Yb  Yb3  1  0.54  0.73  0.73  1.0
  Yb  Yb4  1  0.61  0.58  0.67  1.0
  Yb  Yb5  1  0.61  0.73  0.86  1.0
  Yb  Yb6  1  0.61  0.89  0.67  1.0
  Yb  Yb7  1  0.95  -0.0  0.47  1.0
  Br  Br8  1  0.07  -0.0  0.62  1.0
  Br  Br9  1  0.07  0.13  0.39  1.0
  Br  Br10  1  0.07  0.87  0.39  1.0
  Br  Br11  1  0.36  0.51  0.13  1.0
  Br  Br12  1  0.36  0.73  0.94  1.0
  Br  Br13  1  0.36  0.96  0.13  1.0
  Br  Br14  1  0.48  0.6  0.81  1.0
  Br  Br15  1  0.48  0.73  0.58  1.0
  Br  Br16  1  0.48  0.87  0.81  1.0
  Br  Br17  1  0.76  -0.0  0.26  1.0
  Br  Br18  1  0.76  0.22  0.07  1.0
  Br  Br19  1  0.76  0.78  0.07  1.0
  O  O20  1  0.32  0.73  0.73  1.0
  O  O21  1  0.72  -0.0  0.47  1.0

Yb Yb Yb Yb Yb Yb Yb Yb Br Br Br Br Br Br Br Br Br Br Br Br O O