# generated using pymatgen
data_LiHSeO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15510200
_cell_length_b   5.37071900
_cell_length_c   11.39260800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHSeO3
_chemical_formula_sum   'Li4 H4 Se4 O12'
_cell_volume   315.42262917
_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
  Li  Li0  1  0.99393000  0.93819000  0.66802700  1
  Li  Li1  1  0.49393000  0.56181000  0.33197300  1
  Li  Li2  1  0.00607000  0.43819000  0.83197300  1
  Li  Li3  1  0.50607000  0.06181000  0.16802700  1
  H  H4  1  0.98131700  0.92867200  0.08380500  1
  H  H5  1  0.48131700  0.57132800  0.91619500  1
  H  H6  1  0.01868300  0.42867200  0.41619500  1
  H  H7  1  0.51868300  0.07132800  0.58380500  1
  Se  Se8  1  0.87410600  0.51282700  0.10014300  1
  Se  Se9  1  0.37410600  0.98717300  0.89985700  1
  Se  Se10  1  0.12589400  0.01282700  0.39985700  1
  Se  Se11  1  0.62589400  0.48717300  0.60014300  1
  O  O12  1  0.75321900  0.46535900  0.96291300  1
  O  O13  1  0.86037300  0.59274700  0.69095100  1
  O  O14  1  0.13962700  0.09274700  0.80904900  1
  O  O15  1  0.63962700  0.40725300  0.19095100  1
  O  O16  1  0.68189500  0.15030800  0.61917400  1
  O  O17  1  0.18189500  0.34969200  0.38082600  1
  O  O18  1  0.31810500  0.65030800  0.88082600  1
  O  O19  1  0.81810500  0.84969200  0.11917400  1
  O  O20  1  0.24678100  0.96535900  0.53708700  1
  O  O21  1  0.74678100  0.53464100  0.46291300  1
  O  O22  1  0.36037300  0.90725300  0.30904900  1
  O  O23  1  0.25321900  0.03464100  0.03708700  1
