# generated using pymatgen
data_Ca3Si2IrPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72267417
_cell_length_b   7.83123412
_cell_length_c   13.29339126
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Si2IrPd
_chemical_formula_sum   'Ca12 Si8 Ir4 Pd4'
_cell_volume   595.75132214
_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  0.14030075  0.61057478  0.10436516  1.0
  Ca  Ca1  1  0.14030075  0.88942522  0.89563484  1.0
  Ca  Ca2  1  0.85969925  0.11057478  0.39563484  1.0
  Ca  Ca3  1  0.85969925  0.38942522  0.60436516  1.0
  Ca  Ca4  1  0.87736808  0.38454536  0.89888684  1.0
  Ca  Ca5  1  0.87736808  0.11545464  0.10111316  1.0
  Ca  Ca6  1  0.12263192  0.88454536  0.60111316  1.0
  Ca  Ca7  1  0.12263192  0.61545464  0.39888684  1.0
  Ca  Ca8  1  0.35847819  0.26605644  0.24879684  1.0
  Ca  Ca9  1  0.35847819  0.23394356  0.75120316  1.0
  Ca  Ca10  1  0.64152181  0.76605644  0.25120316  1.0
  Ca  Ca11  1  0.64152181  0.73394356  0.74879684  1.0
  Si  Si12  1  0.42136783  0.25000000  0.00000000  1.0
  Si  Si13  1  0.57863217  0.75000000  0.50000000  1.0
  Si  Si14  1  0.61720818  0.75000000  0.00000000  1.0
  Si  Si15  1  0.38279182  0.25000000  0.50000000  1.0
  Si  Si16  1  0.83658360  0.41540812  0.24503723  1.0
  Si  Si17  1  0.83658360  0.08459188  0.75496277  1.0
  Si  Si18  1  0.16341640  0.91540812  0.25496277  1.0
  Si  Si19  1  0.16341640  0.58459188  0.74503723  1.0
  Ir  Ir20  1  0.63588224  0.47849719  0.08556266  1.0
  Ir  Ir21  1  0.63588224  0.02150281  0.91443734  1.0
  Ir  Ir22  1  0.36411776  0.97849719  0.41443734  1.0
  Ir  Ir23  1  0.36411776  0.52150281  0.58556266  1.0
  Pd  Pd24  1  0.37222449  0.52992729  0.90711541  1.0
  Pd  Pd25  1  0.37222449  0.97007271  0.09288459  1.0
  Pd  Pd26  1  0.62777551  0.02992729  0.59288459  1.0
  Pd  Pd27  1  0.62777551  0.47007271  0.40711541  1.0