# generated using pymatgen
data_Ca3(SnPd)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83325433
_cell_length_b   8.58036064
_cell_length_c   13.98014338
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3(SnPd)2
_chemical_formula_sum   'Ca12 Sn8 Pd8'
_cell_volume   699.72610951
_cell_formula_units_Z   4
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  0.15094299  0.39468181  0.59967340  1.0
  Ca  Ca1  1  0.84905701  0.60531819  0.09967340  1.0
  Ca  Ca2  1  0.15094299  0.10531819  0.40032660  1.0
  Ca  Ca3  1  0.84905701  0.89468181  0.90032660  1.0
  Ca  Ca4  1  0.84905701  0.60531819  0.40032660  1.0
  Ca  Ca5  1  0.15094299  0.39468181  0.90032660  1.0
  Ca  Ca6  1  0.84905701  0.89468181  0.59967340  1.0
  Ca  Ca7  1  0.15094299  0.10531819  0.09967340  1.0
  Ca  Ca8  1  0.64458472  0.25239611  0.75000000  1.0
  Ca  Ca9  1  0.35541528  0.74760389  0.25000000  1.0
  Ca  Ca10  1  0.64458472  0.24760389  0.25000000  1.0
  Ca  Ca11  1  0.35541528  0.75239611  0.75000000  1.0
  Sn  Sn12  1  0.65267751  0.25000000  0.50000000  1.0
  Sn  Sn13  1  0.34732249  0.75000000  0.00000000  1.0
  Sn  Sn14  1  0.34732249  0.75000000  0.50000000  1.0
  Sn  Sn15  1  0.65267751  0.25000000  0.00000000  1.0
  Sn  Sn16  1  0.14776789  0.09857319  0.75000000  1.0
  Sn  Sn17  1  0.85223211  0.90142681  0.25000000  1.0
  Sn  Sn18  1  0.14776789  0.40142681  0.25000000  1.0
  Sn  Sn19  1  0.85223211  0.59857319  0.75000000  1.0
  Pd  Pd20  1  0.37781525  0.03511614  0.58778908  1.0
  Pd  Pd21  1  0.62218475  0.96488386  0.08778908  1.0
  Pd  Pd22  1  0.37781525  0.46488386  0.41221092  1.0
  Pd  Pd23  1  0.62218475  0.53511614  0.91221092  1.0
  Pd  Pd24  1  0.62218475  0.96488386  0.41221092  1.0
  Pd  Pd25  1  0.37781525  0.03511614  0.91221092  1.0
  Pd  Pd26  1  0.62218475  0.53511614  0.58778908  1.0
  Pd  Pd27  1  0.37781525  0.46488386  0.08778908  1.0