# generated using pymatgen
data_CaYb(YIn)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38714747
_cell_length_b   5.38714657
_cell_length_c   6.88252983
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001152
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaYb(YIn)2
_chemical_formula_sum   'Ca1 Yb1 Y2 In2'
_cell_volume   172.98017787
_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  0.00000000  0.00000000  0.50000000  1.0
  Yb  Yb1  1  0.00000000  0.00000000  0.00000000  1.0
  Y  Y2  1  0.33333300  0.66666700  0.75513673  1.0
  Y  Y3  1  0.66666700  0.33333300  0.24486327  1.0
  In  In4  1  0.33333300  0.66666700  0.24961006  1.0
  In  In5  1  0.66666700  0.33333300  0.75038994  1.0