# generated using pymatgen
data_CaNdGaIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66740696
_cell_length_b   5.66740613
_cell_length_c   5.66740641
_cell_angle_alpha   137.71022840
_cell_angle_beta   118.49670719
_cell_angle_gamma   77.47535730
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNdGaIr2
_chemical_formula_sum   'Ca1 Nd1 Ga1 Ir2'
_cell_volume   104.75832447
_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  0.29736086  0.79736086  0.50000000  1.0
  Nd  Nd1  1  0.69697177  0.19697277  0.50000000  1.0
  Ga  Ga2  1  0.00071432  0.00071432  1.00000000  1.0
  Ir  Ir3  1  0.73786211  0.50247553  0.23538658  1.0
  Ir  Ir4  1  0.26708895  0.50247553  0.76461342  1.0