# generated using pymatgen
data_CaAcGaIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81002320
_cell_length_b   5.81002380
_cell_length_c   5.81002303
_cell_angle_alpha   138.32961199
_cell_angle_beta   119.08366952
_cell_angle_gamma   76.52221888
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaAcGaIr2
_chemical_formula_sum   'Ca1 Ac1 Ga1 Ir2'
_cell_volume   111.06138436
_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  0.30063690  0.80063690  0.50000000  1.0
  Ac  Ac1  1  0.69669089  0.19669189  0.50000000  1.0
  Ga  Ga2  1  0.00310771  0.00310771  1.00000000  1.0
  Ir  Ir3  1  0.74108905  0.49978175  0.24130830  1.0
  Ir  Ir4  1  0.25847345  0.49978175  0.75869170  1.0