# generated using pymatgen
data_Ca11ErPd12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71652886
_cell_length_b   4.43321553
_cell_length_c   22.06016621
_cell_angle_alpha   90.00000000
_cell_angle_beta   96.64277261
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca11ErPd12
_chemical_formula_sum   'Ca11 Er1 Pd12'
_cell_volume   555.30890893
_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  0.19308121  0.75000000  0.10674217  1.0
  Ca  Ca1  1  0.51226362  0.25000100  0.22485913  1.0
  Ca  Ca2  1  0.02644659  0.75000000  0.27091814  1.0
  Ca  Ca3  1  0.81176509  0.25000100  0.39269768  1.0
  Ca  Ca4  1  0.33284411  0.75000000  0.43829270  1.0
  Ca  Ca5  1  0.66312090  0.25000100  0.56042250  1.0
  Ca  Ca6  1  0.18536267  0.75000000  0.60625115  1.0
  Ca  Ca7  1  0.96955297  0.25000100  0.72818398  1.0
  Ca  Ca8  1  0.49170086  0.75000000  0.77464730  1.0
  Ca  Ca9  1  0.81948239  0.25000100  0.89617947  1.0
  Ca  Ca10  1  0.33203878  0.75000000  0.94176976  1.0
  Er  Er11  1  0.67095128  0.25000100  0.06057895  1.0
  Pd  Pd12  1  0.15468386  0.25000100  0.01744097  1.0
  Pd  Pd13  1  0.70682670  0.75000000  0.14517333  1.0
  Pd  Pd14  1  0.98790209  0.25000100  0.17549457  1.0
  Pd  Pd15  1  0.55143312  0.75000000  0.31943301  1.0
  Pd  Pd16  1  0.28703516  0.25000100  0.34275571  1.0
  Pd  Pd17  1  0.85476458  0.75000000  0.48740485  1.0
  Pd  Pd18  1  0.14116666  0.25000100  0.51115170  1.0
  Pd  Pd19  1  0.70881307  0.75000000  0.65546021  1.0
  Pd  Pd20  1  0.44593236  0.25000100  0.67952790  1.0
  Pd  Pd21  1  0.01048653  0.75000000  0.82189019  1.0
  Pd  Pd22  1  0.29662486  0.25000100  0.84717261  1.0
  Pd  Pd23  1  0.84572253  0.75000000  0.99555100  1.0