# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22442300
_cell_length_b   9.07489613
_cell_length_c   11.42612772
_cell_angle_alpha   112.69386250
_cell_angle_beta   102.46913495
_cell_angle_gamma   89.72159821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   486.14218774
_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  0.02741500  0.02954700  0.39544900  1
  Li  Li1  1  0.29662200  0.27904700  0.91450700  1
  Li  Li2  1  0.26743800  0.24483700  0.16381800  1
  Li  Li3  1  0.97967300  0.00220800  0.66137600  1
  Li  Li4  1  0.75955600  0.74080700  0.15191600  1
  Fe  Fe5  1  0.00642100  0.35890600  0.37723600  1
  Fe  Fe6  1  0.25792700  0.92992900  0.88236400  1
  Fe  Fe7  1  0.47075100  0.16232300  0.62865400  1
  Fe  Fe8  1  0.25043500  0.56764000  0.13565800  1
  Fe  Fe9  1  0.77477400  0.44384500  0.87413700  1
  Fe  Fe10  1  0.52512800  0.84394000  0.38716000  1
  Fe  Fe11  1  0.98216300  0.64722400  0.63380600  1
  Fe  Fe12  1  0.74268700  0.05607700  0.11942100  1
  B  B13  1  0.03342700  0.68883300  0.38104700  1
  B  B14  1  0.27512200  0.59433600  0.87473400  1
  B  B15  1  0.48898200  0.81920500  0.63529300  1
  B  B16  1  0.24185500  0.89918700  0.13368900  1
  B  B17  1  0.50759000  0.18210200  0.37467700  1
  B  B18  1  0.76442400  0.11425900  0.87657500  1
  B  B19  1  0.96501700  0.30985800  0.62136000  1
  B  B20  1  0.73186200  0.39582900  0.12503500  1
  O  O21  1  0.02183500  0.10428600  0.86205100  1
  O  O22  1  0.12564400  0.69223700  0.82494400  1
  O  O23  1  0.15427300  0.48898300  0.91469700  1
  O  O24  1  0.08227700  0.16954200  0.60594000  1
  O  O25  1  0.05206200  0.41702100  0.57411700  1
  O  O26  1  0.23424700  0.83084700  0.66159000  1
  O  O27  1  0.26047000  0.66062100  0.33700300  1
  O  O28  1  0.54007400  0.60048700  0.88946300  1
  O  O29  1  0.61605400  0.23260700  0.84673400  1
  O  O30  1  0.42365700  0.07546100  0.42101600  1
  O  O31  1  0.34405400  0.29132400  0.35087100  1
  O  O32  1  0.64639800  0.01921500  0.92102200  1
  O  O33  1  0.33755300  0.00985800  0.09149500  1
  O  O34  1  0.63549400  0.69666600  0.64029300  1
  O  O35  1  0.58832900  0.93642900  0.60189000  1
  O  O36  1  0.40458000  0.79023200  0.16236500  1
  O  O37  1  0.46349300  0.37619600  0.10904600  1
  O  O38  1  0.75664400  0.34593100  0.68132200  1
  O  O39  1  0.75829500  0.17481300  0.34684200  1
  O  O40  1  0.94187800  0.58456700  0.43078700  1
  O  O41  1  0.89449400  0.81509900  0.37310100  1
  O  O42  1  0.84284300  0.50418100  0.08590300  1
  O  O43  1  0.89585600  0.30365800  0.17842900  1
  O  O44  1  0.98672300  0.89998700  0.14712700  1
