# generated using pymatgen
data_LiFe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32426600
_cell_length_b   9.02163015
_cell_length_c   11.30151634
_cell_angle_alpha   113.30830377
_cell_angle_beta   102.76801313
_cell_angle_gamma   90.10500005
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe4(BO3)4
_chemical_formula_sum   'Li2 Fe8 B8 O24'
_cell_volume   483.80020340
_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
  Li  Li0  1  0.39898500  0.04158200  0.09788600  1
  Li  Li1  1  0.06954900  0.40810300  0.84061900  1
  Fe  Fe2  1  0.59679000  0.60895500  0.87442300  1
  Fe  Fe3  1  0.90094200  0.89800900  0.12445400  1
  Fe  Fe4  1  0.15737900  0.47641600  0.61730700  1
  Fe  Fe5  1  0.34638700  0.01728800  0.37178400  1
  Fe  Fe6  1  0.65029900  0.98057000  0.62598700  1
  Fe  Fe7  1  0.84899700  0.51975600  0.36855300  1
  Fe  Fe8  1  0.09595800  0.08445800  0.86723400  1
  Fe  Fe9  1  0.39780700  0.39893300  0.12087100  1
  B  B10  1  0.35566900  0.35329400  0.36685500  1
  B  B11  1  0.11303500  0.76186400  0.87685900  1
  B  B12  1  0.85625900  0.85835000  0.37652700  1
  B  B13  1  0.59705200  0.27449600  0.87058400  1
  B  B14  1  0.14864700  0.14043400  0.62361700  1
  B  B15  1  0.39532500  0.72844800  0.12197100  1
  B  B16  1  0.64879600  0.64225000  0.62308200  1
  B  B17  1  0.89059700  0.23078000  0.12291500  1
  O  O18  1  0.88116800  0.76366300  0.91338800  1
  O  O19  1  0.53154800  0.54321600  0.66982800  1
  O  O20  1  0.76337900  0.09766800  0.11747300  1
  O  O21  1  0.44283400  0.20916900  0.35569200  1
  O  O22  1  0.14244700  0.40560300  0.42207700  1
  O  O23  1  0.20643400  0.60638500  0.82344100  1
  O  O24  1  0.71894000  0.40789400  0.86853900  1
  O  O25  1  0.97606800  0.95942000  0.33497900  1
  O  O26  1  0.30720500  0.88270400  0.17290800  1
  O  O27  1  0.36326300  0.09496200  0.57106900  1
  O  O28  1  0.06927500  0.29158400  0.64570700  1
  O  O29  1  0.60322000  0.71760700  0.06418900  1
  O  O30  1  0.36883000  0.28917500  0.91766100  1
  O  O31  1  0.63623200  0.90692200  0.42557800  1
  O  O32  1  0.69662400  0.12634700  0.82369300  1
  O  O33  1  0.02644600  0.03669500  0.66145700  1
  O  O34  1  0.28002600  0.59614900  0.12426500  1
  O  O35  1  0.78338500  0.38086000  0.16441400  1
  O  O36  1  0.86172300  0.58642500  0.56932800  1
  O  O37  1  0.55733400  0.78241400  0.62863500  1
  O  O38  1  0.94705500  0.71605700  0.36925900  1
  O  O39  1  0.24891700  0.89899700  0.89846500  1
  O  O40  1  0.47103400  0.45631900  0.32408500  1
  O  O41  1  0.13129600  0.22403400  0.08841400  1
