# generated using pymatgen
data_Ca5La5Ir4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.77052647
_cell_length_b   9.00942823
_cell_length_c   7.46816447
_cell_angle_alpha   83.70615443
_cell_angle_beta   83.12345210
_cell_angle_gamma   44.81198614
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5La5Ir4
_chemical_formula_sum   'Ca5 La5 Ir4'
_cell_volume   412.65399341
_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  0.01270470  0.81115549  0.90910979  1.0
  Ca  Ca1  1  0.19739996  0.98949366  0.58932115  1.0
  Ca  Ca2  1  0.98945792  0.18680639  0.09083154  1.0
  Ca  Ca3  1  0.80287331  0.00974892  0.41357124  1.0
  Ca  Ca4  1  0.35022054  0.21160437  0.81540813  1.0
  La  La5  1  0.78599449  0.64981964  0.67857152  1.0
  La  La6  1  0.64045614  0.79511097  0.17492744  1.0
  La  La7  1  0.21432437  0.35332246  0.31617292  1.0
  La  La8  1  0.56444001  0.42692608  0.75351894  1.0
  La  La9  1  0.43747977  0.56155993  0.25582086  1.0
  Ir  Ir10  1  0.17762033  0.59079784  0.56634502  1.0
  Ir  Ir11  1  0.41343751  0.80097027  0.93317836  1.0
  Ir  Ir12  1  0.81804401  0.42292206  0.42788139  1.0
  Ir  Ir13  1  0.59554695  0.18976092  0.07534070  1.0