# generated using pymatgen
data_KBa3(BeAs)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.32565161
_cell_length_b   8.55550107
_cell_length_c   7.61125167
_cell_angle_alpha   63.64874615
_cell_angle_beta   75.01530991
_cell_angle_gamma   96.85974796
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa3(BeAs)8
_chemical_formula_sum   'K1 Ba3 Be8 As8'
_cell_volume   397.52610641
_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
  Ba  Ba1  1  0.99967743  0.48461838  0.75783870  1.0
  Ba  Ba2  1  0.00000000  0.00000000  0.50000000  1.0
  Ba  Ba3  1  0.00032257  0.51538162  0.24216130  1.0
  Be  Be4  1  0.50302934  0.62476771  0.31088083  1.0
  Be  Be5  1  0.49699091  0.62293004  0.81390404  1.0
  Be  Be6  1  0.49708467  0.12405140  0.06360882  1.0
  Be  Be7  1  0.49532044  0.12475248  0.56127236  1.0
  Be  Be8  1  0.49697066  0.37523229  0.68911917  1.0
  Be  Be9  1  0.50300909  0.37706996  0.18609596  1.0
  Be  Be10  1  0.50467956  0.87524752  0.43872764  1.0
  Be  Be11  1  0.50291533  0.87594860  0.93639118  1.0
  As  As12  1  0.30319556  0.32782737  0.50811465  1.0
  As  As13  1  0.30227700  0.32502500  0.01400123  1.0
  As  As14  1  0.30782235  0.82557567  0.26241071  1.0
  As  As15  1  0.30397477  0.82531226  0.76038222  1.0
  As  As16  1  0.69680444  0.67217263  0.49188535  1.0
  As  As17  1  0.69772300  0.67497500  0.98599877  1.0
  As  As18  1  0.69602523  0.17468774  0.23961778  1.0
  As  As19  1  0.69217765  0.17442433  0.73758929  1.0