# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25764500
_cell_length_b   9.09987390
_cell_length_c   11.36067476
_cell_angle_alpha   113.11549929
_cell_angle_beta   102.68460874
_cell_angle_gamma   89.79384522
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.62910961
_cell_formula_units_Z   1
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  0.02866300  0.03084800  0.40075000  1
  Li  Li1  1  0.48714100  0.50977600  0.66428600  1
  Li  Li2  1  0.52537500  0.52893600  0.39400400  1
  Li  Li3  1  0.98842200  0.00965000  0.66721700  1
  Li  Li4  1  0.75815600  0.74642500  0.15780700  1
  Fe  Fe5  1  0.02135300  0.35234400  0.37088400  1
  Fe  Fe6  1  0.27342800  0.93772700  0.88883500  1
  Fe  Fe7  1  0.47034600  0.15720900  0.63077200  1
  Fe  Fe8  1  0.23891700  0.55373600  0.12712700  1
  Fe  Fe9  1  0.77184500  0.43649700  0.88526700  1
  Fe  Fe10  1  0.52258200  0.84927000  0.38087800  1
  Fe  Fe11  1  0.97039700  0.65810300  0.63142000  1
  Fe  Fe12  1  0.74630800  0.06737400  0.12660500  1
  B  B13  1  0.02553800  0.68333700  0.37670700  1
  B  B14  1  0.26208300  0.60175200  0.87418800  1
  B  B15  1  0.47801400  0.81602900  0.62685900  1
  B  B16  1  0.23718600  0.89060500  0.13027400  1
  B  B17  1  0.51923600  0.19250600  0.38127900  1
  B  B18  1  0.76589800  0.10170300  0.87461100  1
  B  B19  1  0.97294000  0.31419900  0.62236500  1
  B  B20  1  0.73076400  0.40311900  0.13620700  1
  O  O21  1  0.01211200  0.07018100  0.85630700  1
  O  O22  1  0.13662700  0.71766800  0.83796100  1
  O  O23  1  0.13235200  0.51078100  0.91960100  1
  O  O24  1  0.08074600  0.17079000  0.60844700  1
  O  O25  1  0.08666600  0.42166500  0.58300000  1
  O  O26  1  0.24726800  0.84866600  0.67153400  1
  O  O27  1  0.26656500  0.65966800  0.34747900  1
  O  O28  1  0.51291400  0.57423100  0.85899000  1
  O  O29  1  0.64209900  0.22042800  0.84089900  1
  O  O30  1  0.41452400  0.07988300  0.41560100  1
  O  O31  1  0.38767800  0.32369900  0.38156200  1
  O  O32  1  0.63522700  0.01443500  0.92236600  1
  O  O33  1  0.34882800  0.98531300  0.07942100  1
  O  O34  1  0.58388900  0.67172300  0.60980500  1
  O  O35  1  0.59770000  0.92830700  0.59552300  1
  O  O36  1  0.39466700  0.78549000  0.16866700  1
  O  O37  1  0.48577100  0.40471100  0.14966600  1
  O  O38  1  0.74803300  0.35045000  0.67156700  1
  O  O39  1  0.76693000  0.17562200  0.34987400  1
  O  O40  1  0.91500800  0.57336900  0.41554800  1
  O  O41  1  0.89226700  0.81008700  0.36624900  1
  O  O42  1  0.83173600  0.50370700  0.08383600  1
  O  O43  1  0.90221000  0.30521700  0.18027000  1
  O  O44  1  0.98374100  0.90173000  0.14344600  1
