# generated using pymatgen
data_LiFe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22650451
_cell_length_b   9.15915514
_cell_length_c   11.37299086
_cell_angle_alpha   66.21105416
_cell_angle_beta   76.73859190
_cell_angle_gamma   89.13152626
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe4(BO3)4
_chemical_formula_sum   'Li2 Fe8 B8 O24'
_cell_volume   483.05546221
_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  0.71526900  0.72784400  0.89860800  1
  Li  Li1  1  0.51602700  0.49555100  0.65324500  1
  Fe  Fe2  1  0.98074200  0.64618700  0.37864500  1
  Fe  Fe3  1  0.74003000  0.07396900  0.87676500  1
  Fe  Fe4  1  0.51089000  0.85161000  0.62951500  1
  Fe  Fe5  1  0.76200600  0.43303800  0.12915000  1
  Fe  Fe6  1  0.23562300  0.55138700  0.88294400  1
  Fe  Fe7  1  0.47048100  0.14921900  0.37865000  1
  Fe  Fe8  1  0.03722900  0.33980100  0.62614100  1
  Fe  Fe9  1  0.26578300  0.93616000  0.12871700  1
  B  B10  1  0.96886300  0.31546600  0.37325700  1
  B  B11  1  0.73768700  0.39650200  0.87325500  1
  B  B12  1  0.53667500  0.18699300  0.62803200  1
  B  B13  1  0.76537500  0.10592600  0.12831000  1
  B  B14  1  0.47309000  0.81238700  0.38051200  1
  B  B15  1  0.23235600  0.89297100  0.88014400  1
  B  B16  1  0.01432600  0.68193200  0.62813300  1
  B  B17  1  0.26636400  0.60732600  0.12697100  1
  O  O18  1  0.97070000  0.90380500  0.88218200  1
  O  O19  1  0.89401500  0.28487200  0.84306100  1
  O  O20  1  0.83583300  0.49095700  0.92847000  1
  O  O21  1  0.84990300  0.78984800  0.65147500  1
  O  O22  1  0.93354600  0.57732400  0.57918400  1
  O  O23  1  0.75099200  0.15138900  0.68629300  1
  O  O24  1  0.73389600  0.33090600  0.32947900  1
  O  O25  1  0.50081200  0.41792500  0.84392700  1
  O  O26  1  0.38071700  0.79257500  0.82969100  1
  O  O27  1  0.53299900  0.92224000  0.43019700  1
  O  O28  1  0.62950800  0.69380300  0.38046600  1
  O  O29  1  0.36452700  0.97601100  0.93126900  1
  O  O30  1  0.63298300  0.02275700  0.07695200  1
  O  O31  1  0.41113000  0.31870400  0.61912100  1
  O  O32  1  0.46235400  0.08098800  0.57691300  1
  O  O33  1  0.62360600  0.21098600  0.17480100  1
  O  O34  1  0.53437600  0.60262100  0.10747600  1
  O  O35  1  0.26140200  0.66868000  0.65900000  1
  O  O36  1  0.24523200  0.82926100  0.33273100  1
  O  O37  1  0.03450700  0.42437400  0.41975200  1
  O  O38  1  0.12441100  0.19525200  0.37281100  1
  O  O39  1  0.12609500  0.51396000  0.08853600  1
  O  O40  1  0.13231500  0.71216800  0.17604100  1
  O  O41  1  0.01970900  0.08365200  0.13310500  1
