# generated using pymatgen
data_Li3FeBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.65792364
_cell_length_b   9.65792364
_cell_length_c   9.65792364
_cell_angle_alpha   116.50313795
_cell_angle_beta   116.50313795
_cell_angle_gamma   96.17158733
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3FeBO4
_chemical_formula_sum   'Li24 Fe8 B8 O32'
_cell_volume   666.47689307
_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  0.92256700  0.09393200  0.13995800  1
  Li  Li1  1  0.82743300  0.15606800  0.36004200  1
  Li  Li2  1  0.90606800  0.04602600  0.82863400  1
  Li  Li3  1  0.53260900  0.17256700  0.32863400  1
  Li  Li4  1  0.41350000  0.26714700  0.10223600  1
  Li  Li5  1  0.71475900  0.56086500  0.13262300  1
  Li  Li6  1  0.21739100  0.07743300  0.17136600  1
  Li  Li7  1  0.84393200  0.20397400  0.67136600  1
  Li  Li8  1  0.73285300  0.83508900  0.14635300  1
  Li  Li9  1  0.43913500  0.57175800  0.15389400  1
  Li  Li10  1  0.79602600  0.46739100  0.63995800  1
  Li  Li11  1  0.95397400  0.78260900  0.86004200  1
  Li  Li12  1  0.31086500  0.67824200  0.34610600  1
  Li  Li13  1  0.41786500  0.28524100  0.84610600  1
  Li  Li14  1  0.01714700  0.41491100  0.35364700  1
  Li  Li15  1  0.68873600  0.58650100  0.85364700  1
  Li  Li16  1  0.03524100  0.68913500  0.36737700  1
  Li  Li17  1  0.42824200  0.58213500  0.86737700  1
  Li  Li18  1  0.58508900  0.93873600  0.60223600  1
  Li  Li19  1  0.33650100  0.98285300  0.39776400  1
  Li  Li20  1  0.16491100  0.31126400  0.89776400  1
  Li  Li21  1  0.32175800  0.66786500  0.63262300  1
  Li  Li22  1  0.06126400  0.66350000  0.64635300  1
  Li  Li23  1  0.33213500  0.96475900  0.65389400  1
  Fe  Fe24  1  0.46138000  0.91921300  0.99411400  1
  Fe  Fe25  1  0.53273400  0.53862000  0.45783200  1
  Fe  Fe26  1  0.66921300  0.17509800  0.95783200  1
  Fe  Fe27  1  0.82490200  0.78273400  0.49411400  1
  Fe  Fe28  1  0.28862000  0.33078700  0.50588600  1
  Fe  Fe29  1  0.08078700  0.07490200  0.54216800  1
  Fe  Fe30  1  0.21726600  0.71138000  0.04216800  1
  Fe  Fe31  1  0.92509800  0.46726600  0.00588600  1
  B  B32  1  0.72652300  0.39677600  0.27669400  1
  B  B33  1  0.55017100  0.27347700  0.67025300  1
  B  B34  1  0.14677600  0.37008200  0.17025300  1
  B  B35  1  0.60322400  0.87991800  0.32974700  1
  B  B36  1  0.62991800  0.80017100  0.77669400  1
  B  B37  1  0.02347700  0.85322400  0.22330600  1
  B  B38  1  0.12008200  0.44982900  0.72330600  1
  B  B39  1  0.19982900  0.97652300  0.82974700  1
  O  O40  1  0.79854000  0.26326800  0.23006200  1
  O  O41  1  0.31847900  0.04854000  0.03527200  1
  O  O42  1  0.59427000  0.36007600  0.08986400  1
  O  O43  1  0.88542200  0.68072900  0.11301700  1
  O  O44  1  0.86457800  0.56927100  0.38698300  1
  O  O45  1  0.64841400  0.38537800  0.37559100  1
  O  O46  1  0.43152100  0.20146000  0.46472800  1
  O  O47  1  0.31927100  0.43228800  0.20469300  1
  O  O48  1  0.52240500  0.13542200  0.70469300  1
  O  O49  1  0.95146000  0.98673200  0.26993800  1
  O  O50  1  0.13537800  0.25978700  0.23696400  1
  O  O51  1  0.72717700  0.35158600  0.73696400  1
  O  O52  1  0.63992400  0.72978800  0.23419400  1
  O  O53  1  0.11007600  0.52021200  0.26580600  1
  O  O54  1  0.49559300  0.40573000  0.76580600  1
  O  O55  1  0.61462200  0.99021300  0.26303600  1
  O  O56  1  0.71679300  0.68152100  0.73006200  1
  O  O57  1  0.22759500  0.11457800  0.79530700  1
  O  O58  1  0.43072900  0.81771200  0.29530700  1
  O  O59  1  0.73673200  0.96679300  0.53527200  1
  O  O60  1  0.47978800  0.74559300  0.58986400  1
  O  O61  1  0.10158600  0.86462200  0.12440900  1
  O  O62  1  0.00978700  0.27282300  0.62440900  1
  O  O63  1  0.18228800  0.47759500  0.61301700  1
  O  O64  1  0.56771200  0.77240500  0.88698300  1
  O  O65  1  0.74021300  0.97717700  0.87559100  1
  O  O66  1  0.27021200  0.50440700  0.91013600  1
  O  O67  1  0.15573000  0.88992400  0.41013600  1
  O  O68  1  0.01326800  0.28320700  0.96472800  1
  O  O69  1  0.03320700  0.56847900  0.76993800  1
  O  O70  1  0.25440700  0.84427000  0.73419400  1
  O  O71  1  0.02282300  0.89841400  0.76303600  1
