# generated using pymatgen
data_Ca11YPd12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72740339
_cell_length_b   4.43447845
_cell_length_c   22.10063483
_cell_angle_alpha   90.00000000
_cell_angle_beta   96.72388004
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca11YPd12
_chemical_formula_sum   'Ca11 Y1 Pd12'
_cell_volume   557.45221449
_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  0.18602115  0.75000000  0.10693332  1.0
  Ca  Ca1  1  0.50618258  0.25000100  0.22593208  1.0
  Ca  Ca2  1  0.02349085  0.75000000  0.27233765  1.0
  Ca  Ca3  1  0.81105690  0.25000100  0.39364472  1.0
  Ca  Ca4  1  0.33313762  0.75000000  0.43929446  1.0
  Ca  Ca5  1  0.66502726  0.25000100  0.56042675  1.0
  Ca  Ca6  1  0.18811543  0.75000000  0.60610850  1.0
  Ca  Ca7  1  0.97291763  0.25000100  0.72711185  1.0
  Ca  Ca8  1  0.49535376  0.75000000  0.77361732  1.0
  Ca  Ca9  1  0.82203284  0.25000100  0.89460259  1.0
  Ca  Ca10  1  0.33384147  0.75000000  0.94035948  1.0
  Y  Y11  1  0.66760728  0.25000100  0.06056128  1.0
  Pd  Pd12  1  0.15275680  0.25000100  0.01594020  1.0
  Pd  Pd13  1  0.70229407  0.75000000  0.14828580  1.0
  Pd  Pd14  1  0.98403956  0.25000100  0.17742095  1.0
  Pd  Pd15  1  0.54813635  0.75000000  0.32059686  1.0
  Pd  Pd16  1  0.28577481  0.25000100  0.34409488  1.0
  Pd  Pd17  1  0.85568753  0.75000000  0.48811272  1.0
  Pd  Pd18  1  0.14263884  0.25000100  0.51165809  1.0
  Pd  Pd19  1  0.71172753  0.75000000  0.65479786  1.0
  Pd  Pd20  1  0.44903802  0.25000100  0.67884919  1.0
  Pd  Pd21  1  0.01362593  0.75000000  0.82050044  1.0
  Pd  Pd22  1  0.29912427  0.25000100  0.84580354  1.0
  Pd  Pd23  1  0.85037251  0.75000000  0.99300946  1.0