# generated using pymatgen
data_Th2B(Ir2Rh)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92907741
_cell_length_b   5.92907609
_cell_length_c   5.95647056
_cell_angle_alpha   59.84703063
_cell_angle_beta   59.84703801
_cell_angle_gamma   60.25138235
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2B(Ir2Rh)2
_chemical_formula_sum   'Th2 B1 Ir4 Rh2'
_cell_volume   147.99756918
_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
  Th  Th0  1  0.75000576  0.75000576  0.75003983  1.0
  Th  Th1  1  0.24999424  0.24999424  0.25005234  1.0
  B  B2  1  0.50000000  0.50000000  0.49882419  1.0
  Ir  Ir3  1  0.75557103  0.75557103  0.24537440  1.0
  Ir  Ir4  1  0.75707423  0.24292577  0.24342788  1.0
  Ir  Ir5  1  0.24292577  0.75707423  0.24342788  1.0
  Ir  Ir6  1  0.24442897  0.24442897  0.75651746  1.0
  Rh  Rh7  1  0.75553671  0.24446329  0.75616751  1.0
  Rh  Rh8  1  0.24446329  0.75553671  0.75616751  1.0