# generated using pymatgen
data_LiFe2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31617000
_cell_length_b   9.05907659
_cell_length_c   11.24568349
_cell_angle_alpha   113.06042998
_cell_angle_beta   101.91591247
_cell_angle_gamma   90.74538481
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe2(BO3)2
_chemical_formula_sum   'Li4 Fe8 B8 O24'
_cell_volume   484.91410227
_cell_formula_units_Z   4
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  0.83710100  0.18312900  0.35105600  1
  Li  Li1  1  0.64439000  0.29768400  0.60183600  1
  Li  Li2  1  0.39203700  0.04233100  0.08434400  1
  Li  Li3  1  0.88940000  0.54830100  0.09257500  1
  Fe  Fe4  1  0.59150000  0.60332200  0.86588600  1
  Fe  Fe5  1  0.90489800  0.90092100  0.11633200  1
  Fe  Fe6  1  0.15610400  0.47613300  0.62182200  1
  Fe  Fe7  1  0.34691900  0.01208800  0.37442900  1
  Fe  Fe8  1  0.64190100  0.96561200  0.62942600  1
  Fe  Fe9  1  0.85117900  0.52293600  0.36860700  1
  Fe  Fe10  1  0.09258800  0.10082600  0.86383700  1
  Fe  Fe11  1  0.39379300  0.40507800  0.12157000  1
  B  B12  1  0.35651000  0.34733800  0.36822600  1
  B  B13  1  0.10666600  0.77140100  0.87427800  1
  B  B14  1  0.84454500  0.85819600  0.36870600  1
  B  B15  1  0.60270200  0.27048400  0.87800200  1
  B  B16  1  0.13830900  0.14478500  0.61962000  1
  B  B17  1  0.39470100  0.73187400  0.12149400  1
  B  B18  1  0.65162900  0.63217800  0.61901700  1
  B  B19  1  0.89914800  0.23352700  0.12715000  1
  O  O20  1  0.87638100  0.76468200  0.91267800  1
  O  O21  1  0.56124700  0.51911200  0.66502100  1
  O  O22  1  0.76729500  0.11361000  0.14469800  1
  O  O23  1  0.47909400  0.21867500  0.38350000  1
  O  O24  1  0.11404700  0.37371500  0.39620000  1
  O  O25  1  0.22797100  0.63197100  0.82830400  1
  O  O26  1  0.70785500  0.41225100  0.88202200  1
  O  O27  1  0.97060500  0.97030300  0.33582400  1
  O  O28  1  0.31386300  0.88924100  0.16956400  1
  O  O29  1  0.37470100  0.11853200  0.57913100  1
  O  O30  1  0.00094200  0.26494800  0.60335400  1
  O  O31  1  0.62388000  0.71297400  0.07537000  1
  O  O32  1  0.37245000  0.26653500  0.91669800  1
  O  O33  1  0.62724900  0.90229100  0.41878600  1
  O  O34  1  0.72853100  0.13241300  0.83993100  1
  O  O35  1  0.04626400  0.04318400  0.67041900  1
  O  O36  1  0.25358300  0.60517000  0.11925200  1
  O  O37  1  0.80796700  0.38598900  0.16063800  1
  O  O38  1  0.86235900  0.59033800  0.55935400  1
  O  O39  1  0.53530900  0.76468100  0.63247700  1
  O  O40  1  0.93437300  0.71343800  0.34853900  1
  O  O41  1  0.21954300  0.91737300  0.89176700  1
  O  O42  1  0.48181600  0.44703900  0.32800400  1
  O  O43  1  0.12621000  0.20687300  0.08216000  1
