# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23516900
_cell_length_b   9.11687576
_cell_length_c   11.34388299
_cell_angle_alpha   112.47873120
_cell_angle_beta   102.93852188
_cell_angle_gamma   89.37135293
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   485.90923995
_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  0.02782900  0.02687500  0.39443900  1
  Li  Li1  1  0.29066900  0.28216800  0.91420500  1
  Li  Li2  1  0.26269200  0.24960200  0.16305900  1
  Li  Li3  1  0.52947400  0.53978600  0.41871000  1
  Li  Li4  1  0.97716800  0.99790900  0.65162400  1
  Fe  Fe5  1  0.02553900  0.34814000  0.38104300  1
  Fe  Fe6  1  0.25887900  0.93010100  0.88003700  1
  Fe  Fe7  1  0.46964300  0.16116200  0.62655200  1
  Fe  Fe8  1  0.24545000  0.57662000  0.13480900  1
  Fe  Fe9  1  0.77332100  0.44434400  0.88001500  1
  Fe  Fe10  1  0.53379100  0.85326100  0.37927700  1
  Fe  Fe11  1  0.98712600  0.64562000  0.63487200  1
  Fe  Fe12  1  0.72890100  0.06001600  0.12389200  1
  B  B13  1  0.03163700  0.69059000  0.38672200  1
  B  B14  1  0.27242300  0.59574100  0.87282700  1
  B  B15  1  0.48468600  0.81643300  0.62761900  1
  B  B16  1  0.23448300  0.90645500  0.13617800  1
  B  B17  1  0.51906800  0.18411900  0.37129200  1
  B  B18  1  0.76483200  0.11399400  0.87978200  1
  B  B19  1  0.96603100  0.31262000  0.62840900  1
  B  B20  1  0.73086700  0.38301700  0.11826200  1
  O  O21  1  0.01903700  0.10174300  0.86279200  1
  O  O22  1  0.11744800  0.69869300  0.82793700  1
  O  O23  1  0.15433500  0.49179700  0.91365800  1
  O  O24  1  0.08018700  0.17106000  0.60747500  1
  O  O25  1  0.05644200  0.42250900  0.58572400  1
  O  O26  1  0.23880100  0.82787700  0.66143800  1
  O  O27  1  0.26909200  0.65965500  0.34799800  1
  O  O28  1  0.53225700  0.59549700  0.87772400  1
  O  O29  1  0.60926200  0.22624300  0.84708200  1
  O  O30  1  0.41002900  0.08374900  0.41593400  1
  O  O31  1  0.39437100  0.31423100  0.35972000  1
  O  O32  1  0.65398400  0.01968300  0.93014500  1
  O  O33  1  0.34865300  0.01223800  0.09334400  1
  O  O34  1  0.62178400  0.68399500  0.61711500  1
  O  O35  1  0.58580500  0.93685900  0.59995700  1
  O  O36  1  0.38134500  0.79699900  0.16997700  1
  O  O37  1  0.46488500  0.38172200  0.11309400  1
  O  O38  1  0.75403300  0.34459700  0.68530700  1
  O  O39  1  0.75681700  0.15183100  0.33262600  1
  O  O40  1  0.91837100  0.58143500  0.42541900  1
  O  O41  1  0.91356500  0.82699600  0.39158400  1
  O  O42  1  0.85707200  0.47858600  0.07579500  1
  O  O43  1  0.88275300  0.27794900  0.16475700  1
  O  O44  1  0.98006700  0.92163800  0.14534100  1
