# generated using pymatgen
data_Li3Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30589400
_cell_length_b   9.06074033
_cell_length_c   11.34775820
_cell_angle_alpha   112.89130141
_cell_angle_beta   103.03624911
_cell_angle_gamma   89.53194676
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe8(BO3)8
_chemical_formula_sum   'Li3 Fe8 B8 O24'
_cell_volume   487.70134004
_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  0.40467500  0.05710600  0.11903000  1
  Li  Li1  1  0.07627300  0.41412900  0.84195400  1
  Li  Li2  1  0.58261900  0.90923700  0.84513300  1
  Fe  Fe3  1  0.60093100  0.59159000  0.87326000  1
  Fe  Fe4  1  0.90339800  0.88766900  0.12003000  1
  Fe  Fe5  1  0.16091700  0.48261300  0.62130100  1
  Fe  Fe6  1  0.34205700  0.01550400  0.37000800  1
  Fe  Fe7  1  0.65744200  0.98143000  0.62202600  1
  Fe  Fe8  1  0.84764000  0.51720900  0.36744500  1
  Fe  Fe9  1  0.09353900  0.09320300  0.87379600  1
  Fe  Fe10  1  0.39620000  0.40051200  0.12094600  1
  B  B11  1  0.35020900  0.35077900  0.36442700  1
  B  B12  1  0.10122800  0.76772600  0.87177700  1
  B  B13  1  0.85656900  0.85537500  0.37438300  1
  B  B14  1  0.59955800  0.26446900  0.87180500  1
  B  B15  1  0.15279800  0.14520800  0.62545600  1
  B  B16  1  0.40224200  0.72948900  0.12210500  1
  B  B17  1  0.65350900  0.64251900  0.62342000  1
  B  B18  1  0.88705100  0.22947500  0.12096000  1
  O  O19  1  0.86356500  0.78374000  0.90419700  1
  O  O20  1  0.52849800  0.54021000  0.66056800  1
  O  O21  1  0.75431400  0.09458900  0.10656200  1
  O  O22  1  0.42994600  0.20227900  0.34457900  1
  O  O23  1  0.14103500  0.40345200  0.42202000  1
  O  O24  1  0.18857800  0.61317300  0.82082500  1
  O  O25  1  0.73923300  0.38652600  0.86922600  1
  O  O26  1  0.97297200  0.95749500  0.33407900  1
  O  O27  1  0.30246500  0.88161900  0.17077600  1
  O  O28  1  0.36194000  0.09225100  0.56850000  1
  O  O29  1  0.08016300  0.29627800  0.64856600  1
  O  O30  1  0.61686700  0.72115000  0.07295300  1
  O  O31  1  0.37163700  0.28779600  0.91977700  1
  O  O32  1  0.63581100  0.90495200  0.42518400  1
  O  O33  1  0.67938700  0.10720000  0.82412400  1
  O  O34  1  0.02744400  0.04521600  0.66549500  1
  O  O35  1  0.28098300  0.59601900  0.12107300  1
  O  O36  1  0.78205200  0.38035200  0.16702900  1
  O  O37  1  0.86139600  0.58866200  0.56537900  1
  O  O38  1  0.57885700  0.79371400  0.64672400  1
  O  O39  1  0.94606900  0.71309300  0.36793600  1
  O  O40  1  0.25500000  0.90185400  0.89178900  1
  O  O41  1  0.46779500  0.45499800  0.32393400  1
  O  O42  1  0.12984100  0.22550800  0.08803900  1
