# generated using pymatgen
data_LiFe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22044000
_cell_length_b   9.19267683
_cell_length_c   11.38401272
_cell_angle_alpha   113.28372584
_cell_angle_beta   102.34458976
_cell_angle_gamma   91.08816255
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe8(BO3)8
_chemical_formula_sum   'Li1 Fe8 B8 O24'
_cell_volume   486.94969397
_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  0.32962000  0.99657100  0.34729900  1
  Fe  Fe1  1  0.64630000  0.65145000  0.62361300  1
  Fe  Fe2  1  0.39361500  0.07255600  0.12247200  1
  Fe  Fe3  1  0.84353700  0.83750500  0.37673500  1
  Fe  Fe4  1  0.10573900  0.43244500  0.87051900  1
  Fe  Fe5  1  0.89088500  0.56573100  0.12432200  1
  Fe  Fe6  1  0.13767200  0.14497000  0.62032800  1
  Fe  Fe7  1  0.35684600  0.35880700  0.37482800  1
  Fe  Fe8  1  0.60739700  0.93270300  0.87187100  1
  B  B9  1  0.64703900  0.31203500  0.61831300  1
  B  B10  1  0.38880600  0.39413200  0.12092200  1
  B  B11  1  0.85679900  0.18179000  0.37301600  1
  B  B12  1  0.10808800  0.10680200  0.87155800  1
  B  B13  1  0.15397900  0.81561200  0.62704900  1
  B  B14  1  0.88638900  0.89695500  0.12700500  1
  B  B15  1  0.33176200  0.68770700  0.37267700  1
  B  B16  1  0.60943100  0.60487500  0.87262700  1
  O  O17  1  0.15126700  0.94341200  0.15254100  1
  O  O18  1  0.30829100  0.29412900  0.17753400  1
  O  O19  1  0.19602600  0.46617400  0.06494200  1
  O  O20  1  0.46280300  0.81754000  0.37502700  1
  O  O21  1  0.46024100  0.58704400  0.42857000  1
  O  O22  1  0.57614100  0.16319900  0.33004900  1
  O  O23  1  0.91970800  0.32699500  0.66894000  1
  O  O24  1  0.64252300  0.41452800  0.12069500  1
  O  O25  1  0.79658800  0.78377600  0.16391700  1
  O  O26  1  0.04874000  0.92224300  0.57699700  1
  O  O27  1  0.99717200  0.69762900  0.62854600  1
  O  O28  1  0.70053200  0.97192300  0.06804500  1
  O  O29  1  0.29718000  0.03236600  0.92976900  1
  O  O30  1  0.00638600  0.29829900  0.36574000  1
  O  O31  1  0.97541400  0.07435000  0.42069800  1
  O  O32  1  0.19869800  0.20880800  0.82100600  1
  O  O33  1  0.35084700  0.57983300  0.86704600  1
  O  O34  1  0.06293700  0.64694200  0.31574000  1
  O  O35  1  0.42922800  0.83229600  0.67558400  1
  O  O36  1  0.54671800  0.42222600  0.56812100  1
  O  O37  1  0.48319400  0.19245000  0.61248500  1
  O  O38  1  0.79564100  0.52549200  0.92449800  1
  O  O39  1  0.70152100  0.71054100  0.82475600  1
  O  O40  1  0.85096200  0.07934500  0.86675700  1
