# generated using pymatgen
data_KAs12PdRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.43252014
_cell_length_b   7.43251978
_cell_length_c   7.43252061
_cell_angle_alpha   109.51000994
_cell_angle_beta   109.51000057
_cell_angle_gamma   109.51000934
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAs12PdRu3
_chemical_formula_sum   'K1 As12 Pd1 Ru3'
_cell_volume   315.61757324
_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
  K  K0  1  0.00000000  0.00000000  0.00000000  1.0
  As  As1  1  0.85937035  0.65049698  0.49832044  1.0
  As  As2  1  0.14062965  0.34950302  0.50167956  1.0
  As  As3  1  0.14932096  0.65025090  0.79988270  1.0
  As  As4  1  0.85067904  0.34974910  0.20011730  1.0
  As  As5  1  0.65049698  0.49832044  0.85937035  1.0
  As  As6  1  0.34950302  0.50167956  0.14062965  1.0
  As  As7  1  0.65025090  0.79988270  0.14932096  1.0
  As  As8  1  0.34974910  0.20011730  0.85067904  1.0
  As  As9  1  0.49832044  0.85937035  0.65049698  1.0
  As  As10  1  0.50167956  0.14062965  0.34950302  1.0
  As  As11  1  0.20011730  0.85067904  0.34974910  1.0
  As  As12  1  0.79988270  0.14932096  0.65025090  1.0
  Pd  Pd13  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru14  1  0.50000000  0.00000000  0.00000000  1.0
  Ru  Ru15  1  0.00000000  0.50000000  0.00000000  1.0
  Ru  Ru16  1  0.00000000  0.00000000  0.50000000  1.0