# generated using pymatgen
data_Ca3Nd(Al3Pd)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.63489053
_cell_length_b   7.62171806
_cell_length_c   9.49709523
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.54498363
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Nd(Al3Pd)6
_chemical_formula_sum   'Ca3 Nd1 Al18 Pd6'
_cell_volume   480.78418551
_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  0.99413363  0.66976532  0.25000000  1.0
  Ca  Ca1  1  0.00474705  0.32972533  0.75000000  1.0
  Ca  Ca2  1  0.67266421  0.99646657  0.25000000  1.0
  Nd  Nd3  1  0.32998849  0.00331472  0.75000000  1.0
  Al  Al4  1  0.13269954  0.13391904  0.25000000  1.0
  Al  Al5  1  0.86838902  0.86696655  0.75000000  1.0
  Al  Al6  1  0.00192617  0.33517663  0.07523892  1.0
  Al  Al7  1  0.99581585  0.66288719  0.92630965  1.0
  Al  Al8  1  0.99581585  0.66288719  0.57369035  1.0
  Al  Al9  1  0.33521688  0.00171082  0.42162000  1.0
  Al  Al10  1  0.00192617  0.33517663  0.42476108  1.0
  Al  Al11  1  0.66743938  0.99829426  0.57352169  1.0
  Al  Al12  1  0.66743938  0.99829426  0.92647831  1.0
  Al  Al13  1  0.33521688  0.00171082  0.07838000  1.0
  Al  Al14  1  0.33379418  0.33467962  0.55048039  1.0
  Al  Al15  1  0.66535508  0.66556745  0.44636885  1.0
  Al  Al16  1  0.66535508  0.66556745  0.05363115  1.0
  Al  Al17  1  0.33379418  0.33467962  0.94951961  1.0
  Al  Al18  1  0.34071576  0.54661379  0.25000000  1.0
  Al  Al19  1  0.65707319  0.45460981  0.75000000  1.0
  Al  Al20  1  0.54453687  0.34255664  0.25000000  1.0
  Al  Al21  1  0.45658287  0.66084196  0.75000000  1.0
  Pd  Pd22  1  0.67130725  0.32774587  0.00027302  1.0
  Pd  Pd23  1  0.32825270  0.67192821  0.99987515  1.0
  Pd  Pd24  1  0.32825270  0.67192821  0.50012485  1.0
  Pd  Pd25  1  0.67130725  0.32774587  0.49972698  1.0
  Pd  Pd26  1  0.00012969  0.99962008  0.00027901  1.0
  Pd  Pd27  1  0.00012969  0.99962008  0.49972099  1.0