# generated using pymatgen
data_KAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75258800
_cell_length_b   7.89397400
_cell_length_c   8.56057300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAs
_chemical_formula_sum   'K4 As4'
_cell_volume   321.16535739
_cell_formula_units_Z   4
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  0.69513000  0.25000000  0.50000000  1.0
  K  K1  1  0.30487000  0.75000000  0.00000000  1.0
  K  K2  1  0.30487000  0.75000000  0.50000000  1.0
  K  K3  1  0.69513000  0.25000000  0.00000000  1.0
  As  As4  1  0.80701500  0.58813600  0.25000000  1.0
  As  As5  1  0.19298500  0.08813600  0.25000000  1.0
  As  As6  1  0.19298500  0.41186400  0.75000000  1.0
  As  As7  1  0.80701500  0.91186400  0.75000000  1.0