# generated using pymatgen
data_KSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07460100
_cell_length_b   9.44876600
_cell_length_c   18.06437800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSe
_chemical_formula_sum   'K16 Se16'
_cell_volume   1036.84983625
_cell_formula_units_Z   16
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  0.18606700  0.68590300  0.12586800  1.0
  K  K1  1  0.81393300  0.18590300  0.37413200  1.0
  K  K2  1  0.31393300  0.31409700  0.62586800  1.0
  K  K3  1  0.68606700  0.81409700  0.87413200  1.0
  K  K4  1  0.81393300  0.31409700  0.87413200  1.0
  K  K5  1  0.18606700  0.81409700  0.62586800  1.0
  K  K6  1  0.68606700  0.68590300  0.37413200  1.0
  K  K7  1  0.31393300  0.18590300  0.12586800  1.0
  K  K8  1  0.68635100  0.81481700  0.12768400  1.0
  K  K9  1  0.31364900  0.31481700  0.37231600  1.0
  K  K10  1  0.81364900  0.18518300  0.62768400  1.0
  K  K11  1  0.18635100  0.68518300  0.87231600  1.0
  K  K12  1  0.31364900  0.18518300  0.87231600  1.0
  K  K13  1  0.68635100  0.68518300  0.62768400  1.0
  K  K14  1  0.18635100  0.81481700  0.37231600  1.0
  K  K15  1  0.81364900  0.31481700  0.12768400  1.0
  Se  Se16  1  0.32399800  0.93826300  0.99989700  1.0
  Se  Se17  1  0.67600200  0.43826300  0.50010300  1.0
  Se  Se18  1  0.17600200  0.06173700  0.49989700  1.0
  Se  Se19  1  0.82399800  0.56173700  0.00010300  1.0
  Se  Se20  1  0.67600200  0.06173700  0.00010300  1.0
  Se  Se21  1  0.32399800  0.56173700  0.49989700  1.0
  Se  Se22  1  0.82399800  0.93826300  0.50010300  1.0
  Se  Se23  1  0.17600200  0.43826300  0.99989700  1.0
  Se  Se24  1  0.49878500  0.50278000  0.23460200  1.0
  Se  Se25  1  0.50121500  0.00278000  0.26539800  1.0
  Se  Se26  1  0.00121500  0.49722000  0.73460200  1.0
  Se  Se27  1  0.99878500  0.99722000  0.76539800  1.0
  Se  Se28  1  0.50121500  0.49722000  0.76539800  1.0
  Se  Se29  1  0.49878500  0.99722000  0.73460200  1.0
  Se  Se30  1  0.99878500  0.50278000  0.26539800  1.0
  Se  Se31  1  0.00121500  0.00278000  0.23460200  1.0