# generated using pymatgen
data_Ca2(Al3Pd)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.61435059
_cell_length_b   7.61434954
_cell_length_c   9.50667906
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.55833671
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2(Al3Pd)3
_chemical_formula_sum   'Ca4 Al18 Pd6'
_cell_volume   479.44723060
_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  0.99600493  0.67040780  0.25000000  1.0
  Ca  Ca1  1  0.00399507  0.32959220  0.75000000  1.0
  Ca  Ca2  1  0.67040780  0.99600493  0.25000000  1.0
  Ca  Ca3  1  0.32959220  0.00399507  0.75000000  1.0
  Al  Al4  1  0.13218212  0.13218212  0.25000000  1.0
  Al  Al5  1  0.86781788  0.86781788  0.75000000  1.0
  Al  Al6  1  0.00205555  0.33486803  0.07512602  1.0
  Al  Al7  1  0.99794445  0.66513197  0.92487398  1.0
  Al  Al8  1  0.99794445  0.66513197  0.57512602  1.0
  Al  Al9  1  0.33486803  0.00205555  0.42487398  1.0
  Al  Al10  1  0.00205555  0.33486803  0.42487398  1.0
  Al  Al11  1  0.66513197  0.99794445  0.57512602  1.0
  Al  Al12  1  0.66513197  0.99794445  0.92487398  1.0
  Al  Al13  1  0.33486803  0.00205555  0.07512602  1.0
  Al  Al14  1  0.33421732  0.33421732  0.55219112  1.0
  Al  Al15  1  0.66578268  0.66578368  0.44780888  1.0
  Al  Al16  1  0.66578268  0.66578368  0.05219112  1.0
  Al  Al17  1  0.33421732  0.33421732  0.94780888  1.0
  Al  Al18  1  0.34043986  0.54393824  0.25000000  1.0
  Al  Al19  1  0.65956014  0.45606176  0.75000000  1.0
  Al  Al20  1  0.54393824  0.34043986  0.25000000  1.0
  Al  Al21  1  0.45606176  0.65956014  0.75000000  1.0
  Pd  Pd22  1  0.67143420  0.32856580  0.00000000  1.0
  Pd  Pd23  1  0.32856580  0.67143420  0.00000000  1.0
  Pd  Pd24  1  0.32856580  0.67143420  0.50000000  1.0
  Pd  Pd25  1  0.67143420  0.32856580  0.50000000  1.0
  Pd  Pd26  1  0.00000000  0.00000000  0.00000000  1.0
  Pd  Pd27  1  0.00000000  0.00000000  0.50000000  1.0