# generated using pymatgen
data_LiBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93296500
_cell_length_b   8.00670700
_cell_length_c   9.47790900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBO4
_chemical_formula_sum   'Li8 B8 O32'
_cell_volume   602.00764834
_cell_formula_units_Z   8
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  0.62772900  0.60915000  0.29655400  1
  Li  Li1  1  0.37227100  0.39085000  0.70344600  1
  Li  Li2  1  0.37227100  0.89085000  0.79655400  1
  Li  Li3  1  0.12772900  0.39085000  0.20344600  1
  Li  Li4  1  0.62772900  0.10915000  0.20344600  1
  Li  Li5  1  0.87227100  0.60915000  0.79655400  1
  Li  Li6  1  0.87227100  0.10915000  0.70344600  1
  Li  Li7  1  0.12772900  0.89085000  0.29655400  1
  B  B8  1  0.84531700  0.84211600  0.06888300  1
  B  B9  1  0.15468300  0.15788400  0.93111700  1
  B  B10  1  0.15468300  0.65788400  0.56888300  1
  B  B11  1  0.34531700  0.15788400  0.43111700  1
  B  B12  1  0.84531700  0.34211600  0.43111700  1
  B  B13  1  0.65468300  0.84211600  0.56888300  1
  B  B14  1  0.65468300  0.34211600  0.93111700  1
  B  B15  1  0.34531700  0.65788400  0.06888300  1
  O  O16  1  0.68314200  0.92446500  0.06787400  1
  O  O17  1  0.31685800  0.07553500  0.93212600  1
  O  O18  1  0.31685800  0.57553500  0.56787400  1
  O  O19  1  0.18314200  0.07553500  0.43212600  1
  O  O20  1  0.68314200  0.42446500  0.43212600  1
  O  O21  1  0.81685800  0.92446500  0.56787400  1
  O  O22  1  0.81685800  0.42446500  0.93212600  1
  O  O23  1  0.18314200  0.57553500  0.06787400  1
  O  O24  1  0.59934000  0.79640800  0.43189600  1
  O  O25  1  0.40066000  0.20359200  0.56810400  1
  O  O26  1  0.40066000  0.70359200  0.93189600  1
  O  O27  1  0.09934000  0.20359200  0.06810400  1
  O  O28  1  0.59934000  0.29640800  0.06810400  1
  O  O29  1  0.90066000  0.79640800  0.93189600  1
  O  O30  1  0.90066000  0.29640800  0.56810400  1
  O  O31  1  0.09934000  0.70359200  0.43189600  1
  O  O32  1  0.95359900  0.94212200  0.15434000  1
  O  O33  1  0.04640100  0.05787800  0.84566000  1
  O  O34  1  0.04640100  0.55787800  0.65434000  1
  O  O35  1  0.45359900  0.05787800  0.34566000  1
  O  O36  1  0.95359900  0.44212200  0.34566000  1
  O  O37  1  0.54640100  0.94212200  0.65434000  1
  O  O38  1  0.54640100  0.44212200  0.84566000  1
  O  O39  1  0.45359900  0.55787800  0.15434000  1
  O  O40  1  0.80041500  0.69902500  0.15526900  1
  O  O41  1  0.19958500  0.30097500  0.84473100  1
  O  O42  1  0.19958500  0.80097500  0.65526900  1
  O  O43  1  0.30041500  0.30097500  0.34473100  1
  O  O44  1  0.80041500  0.19902500  0.34473100  1
  O  O45  1  0.69958500  0.69902500  0.65526900  1
  O  O46  1  0.69958500  0.19902500  0.84473100  1
  O  O47  1  0.30041500  0.80097500  0.15526900  1
