# generated using pymatgen
data_LiFe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25785300
_cell_length_b   5.25818243
_cell_length_c   20.16227652
_cell_angle_alpha   89.95562184
_cell_angle_beta   90.19017187
_cell_angle_gamma   119.21702683
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe4(BO3)4
_chemical_formula_sum   'Li2 Fe8 B8 O24'
_cell_volume   486.50172305
_cell_formula_units_Z   2
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  0.66739300  0.64089300  0.33170100  1
  Li  Li1  1  0.64317800  0.66910800  0.07891900  1
  Fe  Fe2  1  0.01550300  0.67580400  0.18889500  1
  Fe  Fe3  1  0.00395000  0.67490800  0.68955600  1
  Fe  Fe4  1  0.31447800  0.01007700  0.06193900  1
  Fe  Fe5  1  0.32815300  0.99728000  0.56554200  1
  Fe  Fe6  1  0.67675100  0.01738600  0.43928900  1
  Fe  Fe7  1  0.67427700  0.00293700  0.93951600  1
  Fe  Fe8  1  0.00694300  0.31489900  0.31274600  1
  Fe  Fe9  1  0.99817400  0.32521800  0.81448800  1
  B  B10  1  0.99598700  0.34120400  0.06383600  1
  B  B11  1  0.99877200  0.33793400  0.56451600  1
  B  B12  1  0.67073400  0.01065000  0.18672200  1
  B  B13  1  0.66438200  0.00494400  0.68878400  1
  B  B14  1  0.33552500  0.99511200  0.31424700  1
  B  B15  1  0.34197600  0.99735900  0.81366600  1
  B  B16  1  0.01030800  0.66952800  0.43829600  1
  B  B17  1  0.00408000  0.66482600  0.93783700  1
  O  O18  1  0.88535600  0.27371400  0.21187400  1
  O  O19  1  0.87459400  0.27069500  0.71559000  1
  O  O20  1  0.74384700  0.09062800  0.04085200  1
  O  O21  1  0.96677000  0.57949400  0.08661900  1
  O  O22  1  0.73199400  0.12338800  0.53808100  1
  O  O23  1  0.01089900  0.59433900  0.58834900  1
  O  O24  1  0.40277000  0.98000200  0.16814100  1
  O  O25  1  0.78624100  0.72625200  0.42816100  1
  O  O26  1  0.40617600  0.98940500  0.66442500  1
  O  O27  1  0.76452300  0.69971500  0.94064700  1
  O  O28  1  0.71918400  0.77878500  0.17870000  1
  O  O29  1  0.70899000  0.77320000  0.68617300  1
  O  O30  1  0.35142400  0.26012100  0.31598300  1
  O  O31  1  0.29438100  0.22765200  0.81579700  1
  O  O32  1  0.25902500  0.35347600  0.06487300  1
  O  O33  1  0.57255100  0.96320800  0.33751000  1
  O  O34  1  0.23203100  0.29504500  0.56622300  1
  O  O35  1  0.59926600  0.01028100  0.83704500  1
  O  O36  1  0.98289700  0.40582000  0.41734400  1
  O  O37  1  0.98256800  0.40260000  0.91454400  1
  O  O38  1  0.27233400  0.87808000  0.46666400  1
  O  O39  1  0.27267900  0.88190200  0.96012000  1
  O  O40  1  0.08342500  0.74541800  0.29112300  1
  O  O41  1  0.12917600  0.73038200  0.78682900  1
