# generated using pymatgen
data_BaLa2(H6Ir)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12394919
_cell_length_b   5.12394930
_cell_length_c   9.07394081
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999280
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLa2(H6Ir)2
_chemical_formula_sum   'Ba1 La2 H12 Ir2'
_cell_volume   206.31758405
_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
  Ba  Ba0  1  0.00000000  0.00000000  0.00000000  1.0
  La  La1  1  0.66666700  0.33333300  0.36747746  1.0
  La  La2  1  0.33333300  0.66666700  0.63252254  1.0
  H  H3  1  0.17918582  0.82081418  0.36859835  1.0
  H  H4  1  0.64162836  0.82081418  0.36859835  1.0
  H  H5  1  0.17918582  0.35837164  0.36859835  1.0
  H  H6  1  0.82081418  0.17918582  0.63140165  1.0
  H  H7  1  0.35837164  0.17918582  0.63140165  1.0
  H  H8  1  0.82081418  0.64162836  0.63140165  1.0
  H  H9  1  0.51229670  0.02459241  0.85306144  1.0
  H  H10  1  0.51229670  0.48770330  0.85306144  1.0
  H  H11  1  0.97540759  0.48770330  0.85306144  1.0
  H  H12  1  0.48770330  0.97540759  0.14693856  1.0
  H  H13  1  0.48770330  0.51229670  0.14693856  1.0
  H  H14  1  0.02459241  0.51229670  0.14693856  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.74502477  1.0
  Ir  Ir16  1  0.33333300  0.66666700  0.25497523  1.0