# generated using pymatgen
data_CaEr2(Al3Pd2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18951745
_cell_length_b   9.31954980
_cell_length_c   9.31942135
_cell_angle_alpha   120.00178917
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaEr2(Al3Pd2)3
_chemical_formula_sum   'Ca1 Er2 Al9 Pd6'
_cell_volume   315.11616785
_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  0.00000000  0.99998639  0.00000595  1.0
  Er  Er1  1  0.50000000  0.33335471  0.66671687  1.0
  Er  Er2  1  0.50000000  0.66664242  0.33327645  1.0
  Al  Al3  1  0.50000000  0.30625015  0.00000065  1.0
  Al  Al4  1  0.50000000  0.69376039  0.69372163  1.0
  Al  Al5  1  0.50000000  0.00003070  0.30626483  1.0
  Al  Al6  1  0.50000000  0.69374230  0.00000821  1.0
  Al  Al7  1  0.50000000  0.30623861  0.30627102  1.0
  Al  Al8  1  0.50000000  0.99996681  0.69373235  1.0
  Al  Al9  1  0.00000000  0.49999532  0.00000200  1.0
  Al  Al10  1  0.00000000  0.49999727  0.49999223  1.0
  Al  Al11  1  0.00000000  0.99999938  0.50000134  1.0
  Pd  Pd12  1  0.00000000  0.18565763  0.37132105  1.0
  Pd  Pd13  1  0.00000000  0.18560967  0.81437913  1.0
  Pd  Pd14  1  0.00000000  0.62871824  0.81435412  1.0
  Pd  Pd15  1  0.00000000  0.81433572  0.62866971  1.0
  Pd  Pd16  1  0.00000000  0.37124639  0.18563467  1.0
  Pd  Pd17  1  0.00000000  0.81436990  0.18564681  1.0