# generated using pymatgen
data_LiFeB2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.59086200
_cell_length_b   5.71753600
_cell_length_c   6.95362293
_cell_angle_alpha   74.05682471
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeB2O5
_chemical_formula_sum   'Li4 Fe4 B8 O20'
_cell_volume   366.64232686
_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  0.42544700  0.68664800  0.78205200  1
  Li  Li1  1  0.07455300  0.18664800  0.78205200  1
  Li  Li2  1  0.92544700  0.81335200  0.21794800  1
  Li  Li3  1  0.57455300  0.31335200  0.21794800  1
  Fe  Fe4  1  0.82897100  0.78335800  0.75390300  1
  Fe  Fe5  1  0.67102900  0.28335800  0.75390300  1
  Fe  Fe6  1  0.32897100  0.71664200  0.24609700  1
  Fe  Fe7  1  0.17102900  0.21664200  0.24609700  1
  B  B8  1  0.11818300  0.67073600  0.91483000  1
  B  B9  1  0.38181700  0.17073600  0.91483000  1
  B  B10  1  0.09310600  0.74426900  0.54820400  1
  B  B11  1  0.59310600  0.75573100  0.45179600  1
  B  B12  1  0.40689400  0.24426900  0.54820400  1
  B  B13  1  0.90689400  0.25573100  0.45179600  1
  B  B14  1  0.61818300  0.82926400  0.08517000  1
  B  B15  1  0.88181700  0.32926400  0.08517000  1
  O  O16  1  0.70483900  0.92984900  0.92649100  1
  O  O17  1  0.99651100  0.78635600  0.93194700  1
  O  O18  1  0.79516100  0.42984900  0.92649100  1
  O  O19  1  0.50348900  0.28635600  0.93194700  1
  O  O20  1  0.16859200  0.65342300  0.72836900  1
  O  O21  1  0.66788400  0.65815500  0.62341600  1
  O  O22  1  0.33140800  0.15342300  0.72836900  1
  O  O23  1  0.95178900  0.73818700  0.53855800  1
  O  O24  1  0.83211600  0.15815500  0.62341600  1
  O  O25  1  0.45178900  0.76181300  0.46144200  1
  O  O26  1  0.54821100  0.23818700  0.53855800  1
  O  O27  1  0.16788400  0.84184500  0.37658400  1
  O  O28  1  0.04821100  0.26181300  0.46144200  1
  O  O29  1  0.66859200  0.84657700  0.27163100  1
  O  O30  1  0.33211600  0.34184500  0.37658400  1
  O  O31  1  0.83140800  0.34657700  0.27163100  1
  O  O32  1  0.49651100  0.71364400  0.06805300  1
  O  O33  1  0.20483900  0.57015100  0.07350900  1
  O  O34  1  0.00348900  0.21364400  0.06805300  1
  O  O35  1  0.29516100  0.07015100  0.07350900  1
