# generated using pymatgen
data_LiFeBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16103000
_cell_length_b   14.46426305
_cell_length_c   14.47145303
_cell_angle_alpha   60.07779474
_cell_angle_beta   89.20958636
_cell_angle_gamma   89.28442305
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeBO3
_chemical_formula_sum   'Li9 Fe9 B9 O27'
_cell_volume   573.39934967
_cell_formula_units_Z   9
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  0.50817200  0.88319200  0.90032300  1
  Li  Li1  1  0.48643600  0.56256200  0.88478300  1
  Li  Li2  1  0.56050100  0.88404900  0.55294400  1
  Li  Li3  1  0.50593400  0.21638200  0.88389900  1
  Li  Li4  1  0.44952000  0.55377800  0.56314300  1
  Li  Li5  1  0.50312200  0.25088500  0.54671700  1
  Li  Li6  1  0.49412200  0.90036500  0.21655000  1
  Li  Li7  1  0.48933400  0.54635800  0.20323100  1
  Li  Li8  1  0.50054200  0.20252600  0.25158800  1
  Fe  Fe9  1  0.06442800  0.80450600  0.75257100  1
  Fe  Fe10  1  0.00795700  0.44215000  0.80596100  1
  Fe  Fe11  1  0.01063900  0.11284200  0.77427400  1
  Fe  Fe12  1  0.94097100  0.75339100  0.44282500  1
  Fe  Fe13  1  0.97451500  0.46437700  0.43013300  1
  Fe  Fe14  1  0.02251800  0.10580600  0.46521500  1
  Fe  Fe15  1  0.98581600  0.77417400  0.11367500  1
  Fe  Fe16  1  0.98740100  0.42907000  0.10678100  1
  Fe  Fe17  1  0.00962500  0.11313300  0.11295000  1
  B  B18  1  0.99640700  0.66262500  0.99131800  1
  B  B19  1  0.00060800  0.66701800  0.66662700  1
  B  B20  1  0.98657700  0.34622100  0.66351200  1
  B  B21  1  0.01582600  0.99094400  0.34640100  1
  B  B22  1  0.53056700  0.01373700  0.66810600  1
  B  B23  1  0.46697100  0.66770300  0.31921700  1
  B  B24  1  0.99815300  0.33297000  0.33402600  1
  B  B25  1  0.00704100  0.99973500  0.00031600  1
  B  B26  1  0.50358200  0.31798400  0.01474200  1
  O  O27  1  0.01021900  0.91522400  0.98009300  1
  O  O28  1  0.97024600  0.57315800  0.97885900  1
  O  O29  1  0.07719800  0.76305100  0.90356400  1
  O  O30  1  0.56354300  0.91340100  0.67879600  1
  O  O31  1  0.50369300  0.40771300  0.91441300  1
  O  O32  1  0.00747100  0.59260200  0.77431900  1
  O  O33  1  0.07245300  0.77347100  0.63298900  1
  O  O34  1  0.02470400  0.10425100  0.91606400  1
  O  O35  1  0.05483000  0.97815900  0.44816500  1
  O  O36  1  0.05667200  0.33282600  0.76449400  1
  O  O37  1  0.92166200  0.63494500  0.59306800  1
  O  O38  1  0.91899900  0.90405800  0.33366800  1
  O  O39  1  0.94563100  0.25739400  0.65103900  1
  O  O40  1  0.96000700  0.44836300  0.57444900  1
  O  O41  1  0.51474000  0.02426600  0.75855600  1
  O  O42  1  0.44666100  0.67887800  0.40870200  1
  O  O43  1  0.47432600  0.56566900  0.33196900  1
  O  O44  1  0.51381000  0.10291600  0.56635300  1
  O  O45  1  0.98642300  0.97958500  0.10491000  1
  O  O46  1  0.48045500  0.75791800  0.21829600  1
  O  O47  1  0.00947200  0.32643900  0.43292200  1
  O  O48  1  0.98414200  0.24059500  0.32744700  1
  O  O49  1  0.00063300  0.43192100  0.24179200  1
  O  O50  1  0.94445400  0.65056000  0.09240900  1
  O  O51  1  0.06957100  0.09148900  0.25741100  1
  O  O52  1  0.49586400  0.33040500  0.10416800  1
  O  O53  1  0.51065600  0.21717000  0.02478600  1
