# generated using pymatgen
data_Ca3Tb(Al3Pd)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.61583625
_cell_length_b   7.60967592
_cell_length_c   9.46351431
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.55779672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Tb(Al3Pd)6
_chemical_formula_sum   'Ca3 Tb1 Al18 Pd6'
_cell_volume   477.07298656
_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  0.99395743  0.66967827  0.25000000  1.0
  Ca  Ca1  1  0.00453578  0.32973895  0.75000000  1.0
  Ca  Ca2  1  0.67227902  0.99581035  0.25000000  1.0
  Tb  Tb3  1  0.32960054  0.00295774  0.75000000  1.0
  Al  Al4  1  0.13326902  0.13350138  0.25000000  1.0
  Al  Al5  1  0.87089052  0.86809674  0.75000000  1.0
  Al  Al6  1  0.00205399  0.33514660  0.07495118  1.0
  Al  Al7  1  0.99795300  0.66448580  0.92380264  1.0
  Al  Al8  1  0.99795300  0.66448580  0.57619736  1.0
  Al  Al9  1  0.33509194  0.00157434  0.42378523  1.0
  Al  Al10  1  0.00205399  0.33514660  0.42504882  1.0
  Al  Al11  1  0.66570516  0.99891265  0.57598346  1.0
  Al  Al12  1  0.66570516  0.99891265  0.92401654  1.0
  Al  Al13  1  0.33509194  0.00157434  0.07621477  1.0
  Al  Al14  1  0.33333096  0.33292616  0.55445019  1.0
  Al  Al15  1  0.66516961  0.66540718  0.44836777  1.0
  Al  Al16  1  0.66516961  0.66540718  0.05163223  1.0
  Al  Al17  1  0.33333096  0.33292616  0.94554981  1.0
  Al  Al18  1  0.34143714  0.54690202  0.25000000  1.0
  Al  Al19  1  0.65516817  0.45239444  0.75000000  1.0
  Al  Al20  1  0.54442440  0.34200297  0.25000000  1.0
  Al  Al21  1  0.45626124  0.66304606  0.75000000  1.0
  Pd  Pd22  1  0.67104562  0.32734763  0.99931828  1.0
  Pd  Pd23  1  0.32788334  0.67217359  0.99894934  1.0
  Pd  Pd24  1  0.32788334  0.67217359  0.50105066  1.0
  Pd  Pd25  1  0.67104562  0.32734763  0.50068172  1.0
  Pd  Pd26  1  0.00085626  0.99996109  0.99931705  1.0
  Pd  Pd27  1  0.00085626  0.99996109  0.50068295  1.0