# generated using pymatgen
data_Ca5La3(Si3Pd)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.28053653
_cell_length_b   8.24618609
_cell_length_c   8.63479811
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.13783100
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca5La3(Si3Pd)4
_chemical_formula_sum   'Ca5 La3 Si12 Pd4'
_cell_volume   509.90535132
_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  0.49972214  0.50027946  0.75000000  1.0
  Ca  Ca1  1  0.50028122  0.49987554  0.25000000  1.0
  Ca  Ca2  1  0.00055700  0.50027931  0.75000000  1.0
  Ca  Ca3  1  0.99959368  0.49987523  0.25000000  1.0
  Ca  Ca4  1  0.49965923  0.99932012  0.75000000  1.0
  La  La5  1  0.50023222  0.00046477  0.25000000  1.0
  La  La6  1  0.99998927  0.99997975  0.75000000  1.0
  La  La7  1  0.00001547  0.00003063  0.25000000  1.0
  Si  Si8  1  0.83596420  0.16679290  0.99892443  1.0
  Si  Si9  1  0.16402373  0.83319637  0.99950582  1.0
  Si  Si10  1  0.33082890  0.16679305  0.99892427  1.0
  Si  Si11  1  0.16402373  0.83319637  0.50049418  1.0
  Si  Si12  1  0.66917267  0.83319637  0.99950564  1.0
  Si  Si13  1  0.83596420  0.16679290  0.50107557  1.0
  Si  Si14  1  0.83323607  0.66647177  0.00003695  1.0
  Si  Si15  1  0.66917267  0.83319637  0.50049436  1.0
  Si  Si16  1  0.16675877  0.33351769  0.00043880  1.0
  Si  Si17  1  0.33082890  0.16679305  0.50107573  1.0
  Si  Si18  1  0.16675877  0.33351769  0.49956120  1.0
  Si  Si19  1  0.83323607  0.66647177  0.49996305  1.0
  Pd  Pd20  1  0.66604345  0.33208722  0.99726383  1.0
  Pd  Pd21  1  0.33394709  0.66789373  0.99825276  1.0
  Pd  Pd22  1  0.33394709  0.66789373  0.50174724  1.0
  Pd  Pd23  1  0.66604345  0.33208722  0.50273617  1.0