# generated using pymatgen
data_Li5Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26450000
_cell_length_b   9.03936042
_cell_length_c   11.44185419
_cell_angle_alpha   112.97766703
_cell_angle_beta   102.49538123
_cell_angle_gamma   89.62036681
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe8(BO3)8
_chemical_formula_sum   'Li5 Fe8 B8 O24'
_cell_volume   487.57785774
_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  0.27211500  0.26670300  0.87492000  1
  Li  Li1  1  0.48688300  0.50992500  0.66531400  1
  Li  Li2  1  0.25980900  0.23851300  0.15315100  1
  Li  Li3  1  0.52585600  0.54238900  0.40831500  1
  Li  Li4  1  0.77182800  0.74987200  0.16846000  1
  Fe  Fe5  1  0.01389500  0.34788300  0.37982800  1
  Fe  Fe6  1  0.26661100  0.93107000  0.88232000  1
  Fe  Fe7  1  0.49511900  0.15165400  0.63114300  1
  Fe  Fe8  1  0.25026700  0.56350300  0.12925800  1
  Fe  Fe9  1  0.77385200  0.45316000  0.88760800  1
  Fe  Fe10  1  0.51677500  0.85745000  0.38137200  1
  Fe  Fe11  1  0.96653800  0.66146100  0.63538800  1
  Fe  Fe12  1  0.74594500  0.05629600  0.12455000  1
  B  B13  1  0.01479600  0.67456500  0.37017800  1
  B  B14  1  0.26512700  0.60104500  0.87435400  1
  B  B15  1  0.46367500  0.81277900  0.62841100  1
  B  B16  1  0.23509000  0.89304200  0.12670800  1
  B  B17  1  0.52260000  0.19624900  0.38357900  1
  B  B18  1  0.76816600  0.10491400  0.87695500  1
  B  B19  1  0.99590600  0.31830500  0.63223700  1
  B  B20  1  0.73935300  0.39658300  0.13010400  1
  O  O21  1  0.03406700  0.10095500  0.88609700  1
  O  O22  1  0.11070700  0.71739400  0.84792400  1
  O  O23  1  0.16499700  0.49585900  0.91916300  1
  O  O24  1  0.15762600  0.21282300  0.66177800  1
  O  O25  1  0.08493100  0.42139400  0.58035800  1
  O  O26  1  0.25366300  0.83994200  0.68776700  1
  O  O27  1  0.25930100  0.65546400  0.34136800  1
  O  O28  1  0.50748900  0.58951000  0.85008500  1
  O  O29  1  0.62789000  0.21020600  0.82964700  1
  O  O30  1  0.44120900  0.09840400  0.43731000  1
  O  O31  1  0.37046900  0.31501400  0.36260200  1
  O  O32  1  0.63539000  0.01295900  0.92125700  1
  O  O33  1  0.33965800  0.00412900  0.08509900  1
  O  O34  1  0.58031400  0.66885700  0.60393400  1
  O  O35  1  0.55045000  0.92586400  0.58884200  1
  O  O36  1  0.40085000  0.79290300  0.16581600  1
  O  O37  1  0.47480300  0.37874200  0.11891100  1
  O  O38  1  0.74667800  0.33523700  0.65800300  1
  O  O39  1  0.75515900  0.17727500  0.34258900  1
  O  O40  1  0.91907200  0.56707100  0.41850800  1
  O  O41  1  0.86179600  0.78773100  0.35315000  1
  O  O42  1  0.84525300  0.50844300  0.09467000  1
  O  O43  1  0.90581400  0.29730100  0.17690500  1
  O  O44  1  0.97870300  0.88935500  0.13002300  1
