# generated using pymatgen
data_LiY19(Cd3Ni)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.61642922
_cell_length_b   9.61642897
_cell_length_c   9.67564250
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999398
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiY19(Cd3Ni)2
_chemical_formula_sum   'Li1 Y19 Cd6 Ni2'
_cell_volume   774.88657959
_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
  Li  Li0  1  0.00000000  0.00000000  0.50000000  1.0
  Y  Y1  1  0.00000000  0.00000000  0.00000000  1.0
  Y  Y2  1  0.54415538  0.45584462  0.25364753  1.0
  Y  Y3  1  0.54415538  0.08830977  0.25364753  1.0
  Y  Y4  1  0.91169023  0.45584462  0.25364753  1.0
  Y  Y5  1  0.45584462  0.54415538  0.74635247  1.0
  Y  Y6  1  0.45584462  0.91169023  0.74635247  1.0
  Y  Y7  1  0.08830977  0.54415538  0.74635247  1.0
  Y  Y8  1  0.20658265  0.79341735  0.43239137  1.0
  Y  Y9  1  0.20658265  0.41316730  0.43239137  1.0
  Y  Y10  1  0.58683270  0.79341735  0.43239137  1.0
  Y  Y11  1  0.79341735  0.20658265  0.56760863  1.0
  Y  Y12  1  0.79341735  0.58683270  0.56760863  1.0
  Y  Y13  1  0.41316730  0.20658265  0.56760863  1.0
  Y  Y14  1  0.78923392  0.21076608  0.93742581  1.0
  Y  Y15  1  0.78923392  0.57846683  0.93742581  1.0
  Y  Y16  1  0.42153317  0.21076608  0.93742581  1.0
  Y  Y17  1  0.21076608  0.78923392  0.06257419  1.0
  Y  Y18  1  0.21076608  0.42153317  0.06257419  1.0
  Y  Y19  1  0.57846683  0.78923392  0.06257419  1.0
  Cd  Cd20  1  0.88860432  0.11139568  0.25863668  1.0
  Cd  Cd21  1  0.88860432  0.77720864  0.25863668  1.0
  Cd  Cd22  1  0.22279136  0.11139568  0.25863668  1.0
  Cd  Cd23  1  0.11139568  0.88860432  0.74136332  1.0
  Cd  Cd24  1  0.11139568  0.22279136  0.74136332  1.0
  Cd  Cd25  1  0.77720864  0.88860432  0.74136332  1.0
  Ni  Ni26  1  0.33333300  0.66666700  0.25059066  1.0
  Ni  Ni27  1  0.66666700  0.33333300  0.74940934  1.0