data_Yb3Ga8Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.23
_cell_length_b   8.23
_cell_length_c   8.23
_cell_angle_alpha   150.26
_cell_angle_beta   107.66
_cell_angle_gamma   80.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Yb3Ga8Ir3
_chemical_formula_sum   'Yb3 Ga8 Ir3'
_cell_volume   258.47
_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  0.0  0.0  0.0  1.0
  Yb  Yb1  1  0.0  0.0  0.49  1.0
  Yb  Yb2  1  0.0  0.0  0.1  1.0
  Ga  Ga3  1  0.11  0.05  0.76  1.0
  Ga  Ga4  1  0.0  0.81  0.54  1.0
  Ga  Ga5  1  0.11  0.95  0.76  1.0
  Ga  Ga6  1  0.0  0.9  0.54  1.0
  Ga  Ga7  1  0.11  0.31  0.12  1.0
  Ga  Ga8  1  0.0  0.54  0.17  1.0
  Ga  Ga9  1  0.11  0.69  0.12  1.0
  Ga  Ga10  1  0.0  0.17  0.17  1.0
  Ir  Ir11  1  0.0  0.86  0.0  1.0
  Ir  Ir12  1  0.11  0.71  0.0  1.0
  Ir  Ir13  1  0.0  0.15  0.3  1.0

data_Yb3Ga8Ir3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.22
_cell_length_b   8.23
_cell_length_c   8.23
_cell_angle_alpha   72.34
_cell_angle_beta   75.13
_cell_angle_gamma   75.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Yb3Ga8Ir3
_chemical_formula_sum   'Yb3 Ga8 Ir3'
_cell_volume   258.47
_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  0.0  0.0  0.0  1.0
  Yb  Yb1  1  0.1  0.0  0.9  1.0
  Yb  Yb2  1  0.49  0.0  0.51  1.0
  Ga  Ga3  1  0.01  0.11  0.56  1.0
  Ga  Ga4  1  0.01  0.11  0.19  1.0
  Ga  Ga5  1  0.17  0.0  0.37  1.0
  Ga  Ga6  1  0.17  0.0  1.0  1.0
  Ga  Ga7  1  0.54  -0.0  0.36  1.0
  Ga  Ga8  1  0.54  -0.0  0.27  1.0
  Ga  Ga9  1  0.65  0.11  0.19  1.0
  Ga  Ga10  1  0.65  0.11  0.29  1.0
  Ir  Ir11  1  -0.0  0.0  0.86  1.0
  Ir  Ir12  1  0.3  0.0  0.85  1.0
  Ir  Ir13  1  0.89  0.11  0.71  1.0

Yb Yb Yb Ga Ga Ga Ga Ga Ga Ga Ga Ir Ir Ir
Yb Yb Yb Ga Ga Ga Ga Ga Ga Ga Ga Ir Ir Ir 0 10 o o o 0 2 o o o 1 6 o - o 2 11 o - o 2 13 o o o 3 5 o - o 3 7 o o + 4 6 o o o 4 8 o o o 5 7 o + + 6 8 o o o 7 8 o o o 9 12 o o o 11 12 o o o 