# generated using pymatgen
data_Li3Fe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25652300
_cell_length_b   9.09491841
_cell_length_c   10.20398906
_cell_angle_alpha   89.97701240
_cell_angle_beta   88.50728122
_cell_angle_gamma   89.62537596
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4(BO3)4
_chemical_formula_sum   'Li6 Fe8 B8 O24'
_cell_volume   487.65273031
_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  0.65358800  0.99110700  0.91903700  1
  Li  Li1  1  0.16373700  0.49943600  0.90311600  1
  Li  Li2  1  0.83486900  0.50871100  0.66064600  1
  Li  Li3  1  0.84588600  0.48590900  0.16860400  1
  Li  Li4  1  0.33252600  0.01144800  0.65662500  1
  Li  Li5  1  0.65585900  0.00215900  0.40817300  1
  Fe  Fe6  1  0.16335500  0.83784200  0.88032700  1
  Fe  Fe7  1  0.83791700  0.83997500  0.63068500  1
  Fe  Fe8  1  0.34186700  0.67257200  0.13716400  1
  Fe  Fe9  1  0.65995500  0.65748300  0.38691700  1
  Fe  Fe10  1  0.33092700  0.34312200  0.62780600  1
  Fe  Fe11  1  0.16292300  0.17069900  0.37457700  1
  Fe  Fe12  1  0.65817900  0.33422700  0.88112500  1
  Fe  Fe13  1  0.84178000  0.15260100  0.12903900  1
  B  B14  1  0.15801300  0.84237900  0.37445600  1
  B  B15  1  0.33392000  0.66930100  0.63194700  1
  B  B16  1  0.83137900  0.82219400  0.12526800  1
  B  B17  1  0.66626000  0.66766000  0.87937800  1
  B  B18  1  0.34003600  0.34242000  0.13263400  1
  B  B19  1  0.66365100  0.32312000  0.37488300  1
  B  B20  1  0.16212500  0.16626200  0.87712500  1
  B  B21  1  0.82822100  0.17042100  0.62296300  1
  O  O22  1  0.29130200  0.97339200  0.38332200  1
  O  O23  1  0.08788600  0.81294700  0.08839500  1
  O  O24  1  0.70182800  0.95178300  0.11740900  1
  O  O25  1  0.22068100  0.80543100  0.66350000  1
  O  O26  1  0.28907800  0.71724900  0.32950500  1
  O  O27  1  0.77695000  0.80210200  0.84534500  1
  O  O28  1  0.90101500  0.83694000  0.41142400  1
  O  O29  1  0.41330000  0.66538300  0.92798600  1
  O  O30  1  0.19158800  0.54406400  0.63944000  1
  O  O31  1  0.59381800  0.66280700  0.59568600  1
  O  O32  1  0.70884200  0.69020500  0.16284300  1
  O  O33  1  0.20634300  0.47513400  0.11775500  1
  O  O34  1  0.80357000  0.53827100  0.86447700  1
  O  O35  1  0.27468000  0.30210100  0.85026900  1
  O  O36  1  0.41389700  0.31138500  0.42158800  1
  O  O37  1  0.77970900  0.45341900  0.35670600  1
  O  O38  1  0.59846000  0.33527400  0.09829700  1
  O  O39  1  0.08775000  0.16744600  0.58450000  1
  O  O40  1  0.20682300  0.22060900  0.17969400  1
  O  O41  1  0.71563300  0.30134000  0.66546900  1
  O  O42  1  0.79519600  0.18867600  0.34680300  1
  O  O43  1  0.30693800  0.03913500  0.85947700  1
  O  O44  1  0.90656300  0.15870200  0.91725300  1
  O  O45  1  0.68700000  0.04268100  0.61340900  1
