# generated using pymatgen
data_CaIn2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90268943
_cell_length_b   5.90268943
_cell_length_c   7.58169005
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   134.14278507
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaIn2Au
_chemical_formula_sum   'Ca2 In4 Au2'
_cell_volume   189.56240717
_cell_formula_units_Z   2
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  0.92504373  0.07495627  0.75000000  1.0
  Ca  Ca1  1  0.07495627  0.92504373  0.25000000  1.0
  In  In2  1  0.63548795  0.36451205  0.94903917  1.0
  In  In3  1  0.63548795  0.36451205  0.55096083  1.0
  In  In4  1  0.36451205  0.63548795  0.05096083  1.0
  In  In5  1  0.36451205  0.63548795  0.44903917  1.0
  Au  Au6  1  0.21119828  0.78880172  0.75000000  1.0
  Au  Au7  1  0.78880172  0.21119828  0.25000000  1.0