# generated using pymatgen
data_YbThNbIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70498946
_cell_length_b   5.70499026
_cell_length_c   5.25243389
_cell_angle_alpha   57.10640839
_cell_angle_beta   57.10641587
_cell_angle_gamma   60.00000576
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbThNbIr3
_chemical_formula_sum   'Yb1 Th1 Nb1 Ir3'
_cell_volume   115.32047142
_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  0.75400231  0.75400231  0.73799106  1.0
  Th  Th1  1  0.50059056  0.50059056  0.49822831  1.0
  Nb  Nb2  1  0.12431166  0.12431166  0.62706602  1.0
  Ir  Ir3  1  0.62547111  0.12281218  0.12890454  1.0
  Ir  Ir4  1  0.12281218  0.12281218  0.12890454  1.0
  Ir  Ir5  1  0.12281218  0.62547111  0.12890454  1.0