# generated using pymatgen
data_KMnSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.46222620
_cell_length_b   7.46222620
_cell_length_c   7.46222620
_cell_angle_alpha   149.49907223
_cell_angle_beta   149.49907223
_cell_angle_gamma   43.67721089
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KMnSe2
_chemical_formula_sum   'K1 Mn1 Se2'
_cell_volume   106.74897605
_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
  Mn  Mn1  1  0.25000000  0.75000000  0.50000000  1.0
  Se  Se2  1  0.35603665  0.35603665  0.00000000  1.0
  Se  Se3  1  0.64396335  0.64396335  -0.00000000  1.0