# generated using pymatgen
data_Ba4Li2(CdP2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.28560178
_cell_length_b   10.28560178
_cell_length_c   16.96742100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   154.63154792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Li2(CdP2)3
_chemical_formula_sum   'Ba8 Li4 Cd6 P12'
_cell_volume   769.06474844
_cell_formula_units_Z   2
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
  Ba  Ba0  1  0.98378500  0.01621500  0.37771800  1
  Ba  Ba1  1  0.01621500  0.98378500  0.62228200  1
  Ba  Ba2  1  0.98378500  0.01621500  0.12228200  1
  Ba  Ba3  1  0.01621500  0.98378500  0.87771800  1
  Ba  Ba4  1  0.82841300  0.17158700  0.93158400  1
  Ba  Ba5  1  0.17158700  0.82841300  0.06841600  1
  Ba  Ba6  1  0.82841300  0.17158700  0.56841600  1
  Ba  Ba7  1  0.17158700  0.82841300  0.43158400  1
  Li  Li8  1  0.84920900  0.15079100  0.25000000  1
  Li  Li9  1  0.15079100  0.84920900  0.75000000  1
  Li  Li10  1  0.56299600  0.43700400  0.25000000  1
  Li  Li11  1  0.43700400  0.56299600  0.75000000  1
  Cd  Cd12  1  0.34950500  0.65049500  0.37434300  1
  Cd  Cd13  1  0.65049500  0.34950500  0.62565700  1
  Cd  Cd14  1  0.34950500  0.65049500  0.12565700  1
  Cd  Cd15  1  0.65049500  0.34950500  0.87434300  1
  Cd  Cd16  1  0.70385700  0.29614300  0.25000000  1
  Cd  Cd17  1  0.29614300  0.70385700  0.75000000  1
  P  P18  1  0.78052700  0.21947300  0.38154600  1
  P  P19  1  0.21947300  0.78052700  0.61845400  1
  P  P20  1  0.78052700  0.21947300  0.11845400  1
  P  P21  1  0.21947300  0.78052700  0.88154600  1
  P  P22  1  0.55584900  0.44415100  0.48882200  1
  P  P23  1  0.44415100  0.55584900  0.51117800  1
  P  P24  1  0.55584900  0.44415100  0.01117800  1
  P  P25  1  0.44415100  0.55584900  0.98882200  1
  P  P26  1  0.43032300  0.56967700  0.25000000  1
  P  P27  1  0.56967700  0.43032300  0.75000000  1
  P  P28  1  0.12034200  0.87965800  0.25000000  1
  P  P29  1  0.87965800  0.12034200  0.75000000  1
