data_Ge2BIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84
_cell_length_b   3.07
_cell_length_c   5.03
_cell_angle_alpha   90.0
_cell_angle_beta   110.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2BIr
_chemical_formula_sum   'Ge2 B1 Ir1'
_cell_volume   55.48
_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
  Ge  Ge1  1  0.92  0.53  0.63  1.0
  Ge  Ge2  1  0.15  0.53  0.07  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  Ir  Ir3  1  0.11  0.0  0.35  1.0

data_Ge2BIr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.07
_cell_length_b   3.84
_cell_length_c   5.03
_cell_angle_alpha   110.7
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2BIr
_chemical_formula_sum   'Ge2 B1 Ir1'
_cell_volume   55.48
_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
  Ge  Ge0  1  0.47  0.08  0.37  1.0
  Ge  Ge1  1  0.47  0.85  0.93  1.0
  B  B2  1  0.0  0.0  0.0  1.0
  Ir  Ir3  1  0.0  0.89  0.65  1.0

Ge Ge B Ir