# generated using pymatgen
data_KBa2(BeAs)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36516880
_cell_length_b   7.36945470
_cell_length_c   8.49909671
_cell_angle_alpha   110.30698683
_cell_angle_beta   108.39895484
_cell_angle_gamma   90.00000078
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa2(BeAs)6
_chemical_formula_sum   'K1 Ba2 Be6 As6'
_cell_volume   296.77009372
_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  0.65977415  0.00065089  0.31954631  1.0
  Ba  Ba2  1  0.34022585  0.99934911  0.68045369  1.0
  Be  Be3  1  0.41596610  0.49899972  0.33307244  1.0
  Be  Be4  1  0.08289266  0.50100028  0.66692756  1.0
  Be  Be5  1  0.75014716  0.50000000  1.00000000  1.0
  Be  Be6  1  0.58403390  0.50100028  0.66692756  1.0
  Be  Be7  1  0.24985284  0.50000000  0.00000000  1.0
  Be  Be8  1  0.91710734  0.49899972  0.33307244  1.0
  As  As9  1  0.21795683  0.30326987  0.43591266  1.0
  As  As10  1  0.88357499  0.30436639  0.76714899  1.0
  As  As11  1  0.55083051  0.30568725  0.10166401  1.0
  As  As12  1  0.78204317  0.69673013  0.56408734  1.0
  As  As13  1  0.44916949  0.69431275  0.89833599  1.0
  As  As14  1  0.11642501  0.69563361  0.23285101  1.0