# generated using pymatgen
data_CaLaAlIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74102649
_cell_length_b   5.74102664
_cell_length_c   5.74102709
_cell_angle_alpha   138.71975631
_cell_angle_beta   118.48858088
_cell_angle_gamma   76.79268128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaLaAlIr2
_chemical_formula_sum   'Ca1 La1 Al1 Ir2'
_cell_volume   106.92888587
_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  0.30062826  0.80062726  0.49999900  1.0
  La  La1  1  0.69394003  0.19394003  0.50000000  1.0
  Al  Al2  1  0.00178421  0.00178421  0.00000000  1.0
  Ir  Ir3  1  0.74554487  0.50182325  0.24372162  1.0
  Ir  Ir4  1  0.25810163  0.50182225  0.75627838  1.0