# generated using pymatgen
data_Ca8Cu3Si12Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.08339153
_cell_length_b   8.08339157
_cell_length_c   8.63702364
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca8Cu3Si12Pd
_chemical_formula_sum   'Ca8 Cu3 Si12 Pd1'
_cell_volume   488.74462085
_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  0.50051324  0.49948676  0.74796359  1.0
  Ca  Ca1  1  0.50055924  0.49944076  0.25203738  1.0
  Ca  Ca2  1  0.99897351  0.49948676  0.74796359  1.0
  Ca  Ca3  1  0.99888252  0.49944076  0.25203738  1.0
  Ca  Ca4  1  0.50051324  0.00102649  0.74796359  1.0
  Ca  Ca5  1  0.50055924  0.00111748  0.25203738  1.0
  Ca  Ca6  1  0.00000000  0.00000000  0.75005923  1.0
  Ca  Ca7  1  0.00000000  0.00000000  0.24994014  1.0
  Cu  Cu8  1  0.66666700  0.33333300  0.99992750  1.0
  Cu  Cu9  1  0.33333300  0.66666700  0.00015008  1.0
  Cu  Cu10  1  0.33333300  0.66666700  0.49988050  1.0
  Si  Si11  1  0.83137337  0.16862663  0.00000072  1.0
  Si  Si12  1  0.16847708  0.83152292  0.99999465  1.0
  Si  Si13  1  0.33725427  0.16862663  0.00000072  1.0
  Si  Si14  1  0.16764903  0.83235097  0.49997501  1.0
  Si  Si15  1  0.66304585  0.83152292  0.99999465  1.0
  Si  Si16  1  0.83364761  0.16635239  0.50002250  1.0
  Si  Si17  1  0.83137337  0.66274573  0.00000072  1.0
  Si  Si18  1  0.66469995  0.83235097  0.49997501  1.0
  Si  Si19  1  0.16847708  0.33695415  0.99999465  1.0
  Si  Si20  1  0.33270678  0.16635239  0.50002250  1.0
  Si  Si21  1  0.16764903  0.33530005  0.49997501  1.0
  Si  Si22  1  0.83364761  0.66729322  0.50002250  1.0
  Pd  Pd23  1  0.66666700  0.33333300  0.50005598  1.0