# generated using pymatgen
data_Ca4Si2GePd27
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.83313462
_cell_length_b   8.83313462
_cell_length_c   7.04714121
_cell_angle_alpha   90.63137545
_cell_angle_beta   90.63137545
_cell_angle_gamma   88.75691365
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4Si2GePd27
_chemical_formula_sum   'Ca4 Si2 Ge1 Pd27'
_cell_volume   549.65328650
_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  0.50976014  0.00976014  0.93491125  1.0
  Ca  Ca1  1  0.99023986  0.49023986  0.06508875  1.0
  Ca  Ca2  1  0.00391764  0.99608236  0.50000000  1.0
  Ca  Ca3  1  0.49608236  0.50391764  0.50000000  1.0
  Si  Si4  1  0.50732724  0.00732724  0.44443721  1.0
  Si  Si5  1  0.99267276  0.49267276  0.55556279  1.0
  Ge  Ge6  1  0.25000000  0.75000000  0.00000000  1.0
  Pd  Pd7  1  0.34112295  0.84112295  0.59727305  1.0
  Pd  Pd8  1  0.33438129  0.16860580  0.61873810  1.0
  Pd  Pd9  1  0.66860580  0.83438129  0.61873810  1.0
  Pd  Pd10  1  0.66955309  0.16955309  0.61882155  1.0
  Pd  Pd11  1  0.15887705  0.65887705  0.40272695  1.0
  Pd  Pd12  1  0.16561871  0.33139420  0.38126190  1.0
  Pd  Pd13  1  0.83139420  0.66561871  0.38126190  1.0
  Pd  Pd14  1  0.83044691  0.33044691  0.38117845  1.0
  Pd  Pd15  1  0.50231014  0.77407748  0.25253834  1.0
  Pd  Pd16  1  0.49809408  0.23510229  0.25631889  1.0
  Pd  Pd17  1  0.27407748  0.00231014  0.25253834  1.0
  Pd  Pd18  1  0.73510229  0.99809408  0.25631889  1.0
  Pd  Pd19  1  0.99768986  0.72592252  0.74746166  1.0
  Pd  Pd20  1  0.00190592  0.26489771  0.74368111  1.0
  Pd  Pd21  1  0.22592252  0.49768986  0.74746166  1.0
  Pd  Pd22  1  0.76489771  0.50190592  0.74368111  1.0
  Pd  Pd23  1  0.49703281  0.35495539  0.85709403  1.0
  Pd  Pd24  1  0.48639318  0.66699048  0.86145921  1.0
  Pd  Pd25  1  0.85495539  0.99703281  0.85709403  1.0
  Pd  Pd26  1  0.16699048  0.98639318  0.86145921  1.0
  Pd  Pd27  1  0.00296719  0.14504461  0.14290597  1.0
  Pd  Pd28  1  0.01360682  0.83300952  0.13854079  1.0
  Pd  Pd29  1  0.64504461  0.50296719  0.14290597  1.0
  Pd  Pd30  1  0.33300952  0.51360682  0.13854079  1.0
  Pd  Pd31  1  0.25000000  0.25000000  0.00000000  1.0
  Pd  Pd32  1  0.75000000  0.75000000  0.00000000  1.0
  Pd  Pd33  1  0.75000000  0.25000000  0.00000000  1.0