# generated using pymatgen
data_KNbSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63703191
_cell_length_b   3.63703191
_cell_length_c   16.36843200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999832
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KNbSe2
_chemical_formula_sum   'K2 Nb2 Se4'
_cell_volume   187.51324083
_cell_formula_units_Z   2
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
  K  K1  1  0.00000000  0.00000000  0.50000000  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.25000000  1.0
  Nb  Nb3  1  0.00000000  0.00000000  0.75000000  1.0
  Se  Se4  1  0.33333300  0.66666700  0.15044100  1.0
  Se  Se5  1  0.33333300  0.66666700  0.34955900  1.0
  Se  Se6  1  0.66666700  0.33333300  0.65044100  1.0
  Se  Se7  1  0.66666700  0.33333300  0.84955900  1.0