# generated using pymatgen
data_Li3Fe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23497300
_cell_length_b   9.07736047
_cell_length_c   11.37272717
_cell_angle_alpha   112.60832779
_cell_angle_beta   102.24401582
_cell_angle_gamma   90.03262643
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4(BO3)4
_chemical_formula_sum   'Li6 Fe8 B8 O24'
_cell_volume   485.52808191
_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  0.02800300  0.02784300  0.39376700  1
  Li  Li1  1  0.29601500  0.27933200  0.90885900  1
  Li  Li2  1  0.48928600  0.50902600  0.66673900  1
  Li  Li3  1  0.25956200  0.24572800  0.16392400  1
  Li  Li4  1  0.53072400  0.53814900  0.41123100  1
  Li  Li5  1  0.98141900  0.99994000  0.65781200  1
  Fe  Fe6  1  0.02916500  0.35172600  0.38593700  1
  Fe  Fe7  1  0.26276800  0.92210900  0.87660300  1
  Fe  Fe8  1  0.47863500  0.15860000  0.63107100  1
  Fe  Fe9  1  0.23861800  0.57583500  0.13408000  1
  Fe  Fe10  1  0.77480500  0.45188500  0.88638000  1
  Fe  Fe11  1  0.53664500  0.85317600  0.38053400  1
  Fe  Fe12  1  0.96852100  0.65252800  0.63466600  1
  Fe  Fe13  1  0.72881300  0.05641700  0.12284900  1
  B  B14  1  0.02140100  0.68594900  0.37668000  1
  B  B15  1  0.26855800  0.60032000  0.87720300  1
  B  B16  1  0.47176700  0.81337000  0.62367600  1
  B  B17  1  0.23096400  0.90484700  0.13684600  1
  B  B18  1  0.51971200  0.18296400  0.37230500  1
  B  B19  1  0.76866300  0.11330900  0.88114000  1
  B  B20  1  0.97911200  0.31360600  0.62409300  1
  B  B21  1  0.73738000  0.39163100  0.12920000  1
  O  O22  1  0.02400800  0.10224900  0.86677000  1
  O  O23  1  0.10469900  0.70504400  0.84461100  1
  O  O24  1  0.17643600  0.50048600  0.93324000  1
  O  O25  1  0.08967100  0.17234300  0.61463600  1
  O  O26  1  0.10452500  0.42569100  0.59305200  1
  O  O27  1  0.23932000  0.84145900  0.66636900  1
  O  O28  1  0.26142600  0.65410900  0.33384800  1
  O  O29  1  0.51093100  0.58747800  0.85270000  1
  O  O30  1  0.61395000  0.22056500  0.84453800  1
  O  O31  1  0.40752400  0.07939300  0.41355300  1
  O  O32  1  0.39472300  0.31315100  0.36055500  1
  O  O33  1  0.65341300  0.01943300  0.93292700  1
  O  O34  1  0.35168300  0.01305500  0.09952000  1
  O  O35  1  0.58082900  0.66907400  0.60654200  1
  O  O36  1  0.59170900  0.92647500  0.59294400  1
  O  O37  1  0.37142700  0.78891900  0.16569800  1
  O  O38  1  0.46805500  0.39554100  0.12173200  1
  O  O39  1  0.74391400  0.34495900  0.66251600  1
  O  O40  1  0.76080300  0.15487700  0.33636200  1
  O  O41  1  0.90713700  0.57470100  0.41095200  1
  O  O42  1  0.91322400  0.82493200  0.38543300  1
  O  O43  1  0.87156400  0.49494100  0.09596500  1
  O  O44  1  0.87689800  0.27798900  0.16519400  1
  O  O45  1  0.97785900  0.91867100  0.14778700  1
