# generated using pymatgen
data_CaU2(GaIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.13251985
_cell_length_b   7.13251914
_cell_length_c   3.92976019
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   121.04328103
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaU2(GaIr)3
_chemical_formula_sum   'Ca1 U2 Ga3 Ir3'
_cell_volume   171.28537722
_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
  Ca  Ca0  1  0.41488144  0.41488144  0.50000000  1.0
  U  U1  1  0.58108339  0.00513071  0.50000000  1.0
  U  U2  1  0.00513071  0.58108339  0.50000000  1.0
  Ga  Ga3  1  0.74076046  0.74076046  0.00000000  1.0
  Ga  Ga4  1  0.23931321  0.01204983  0.00000000  1.0
  Ga  Ga5  1  0.01204983  0.23931321  0.00000000  1.0
  Ir  Ir6  1  0.69829138  0.33016093  0.00000000  1.0
  Ir  Ir7  1  0.33016093  0.69829138  0.00000000  1.0
  Ir  Ir8  1  0.97832866  0.97832866  0.50000000  1.0