# generated using pymatgen
data_Li7Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22126800
_cell_length_b   5.23186630
_cell_length_c   20.57736742
_cell_angle_alpha   91.32464743
_cell_angle_beta   89.56776116
_cell_angle_gamma   119.81394217
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li7Fe8(BO3)8
_chemical_formula_sum   'Li7 Fe8 B8 O24'
_cell_volume   487.57751670
_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  0.02234300  0.34522000  0.66682200  1
  Li  Li1  1  0.97596200  0.32142400  0.91722500  1
  Li  Li2  1  0.02365200  0.34844300  0.16822600  1
  Li  Li3  1  0.97427300  0.32412900  0.41542900  1
  Li  Li4  1  0.01363900  0.66726300  0.79246400  1
  Li  Li5  1  0.98806800  0.65506200  0.54253300  1
  Li  Li6  1  0.98847700  0.65483800  0.04475600  1
  Fe  Fe7  1  0.32695800  0.32714000  0.80886400  1
  Fe  Fe8  1  0.33553300  0.32665400  0.30706300  1
  Fe  Fe9  1  0.31439100  0.99481400  0.93465100  1
  Fe  Fe10  1  0.30999400  0.99368700  0.43320500  1
  Fe  Fe11  1  0.67291900  0.99619700  0.55850300  1
  Fe  Fe12  1  0.67339000  0.99802700  0.05892800  1
  Fe  Fe13  1  0.68391400  0.67901200  0.68483000  1
  Fe  Fe14  1  0.68842000  0.68030700  0.18648100  1
  B  B15  1  0.65916600  0.66178900  0.93676300  1
  B  B16  1  0.65883200  0.66371100  0.43526400  1
  B  B17  1  0.66350200  0.99477000  0.81182500  1
  B  B18  1  0.66244100  0.99345500  0.31248300  1
  B  B19  1  0.34189500  0.00437900  0.68656000  1
  B  B20  1  0.34312400  0.00009500  0.18701000  1
  B  B21  1  0.33571600  0.33111600  0.56142200  1
  B  B22  1  0.33617600  0.33010200  0.06198600  1
  O  O23  1  0.67931700  0.74711200  0.79187900  1
  O  O24  1  0.62814500  0.72742700  0.29028300  1
  O  O25  1  0.67365600  0.93042600  0.95126300  1
  O  O26  1  0.39440200  0.41690000  0.91699900  1
  O  O27  1  0.66940000  0.92892200  0.45101400  1
  O  O28  1  0.39398200  0.42180700  0.41276800  1
  O  O29  1  0.39211000  0.97275400  0.82666800  1
  O  O30  1  0.08011700  0.34914800  0.56777200  1
  O  O31  1  0.41612700  0.01680300  0.32903100  1
  O  O32  1  0.07927100  0.34485100  0.06853700  1
  O  O33  1  0.91812100  0.26839100  0.81779100  1
  O  O34  1  0.93869900  0.23492900  0.32068500  1
  O  O35  1  0.09020000  0.72941200  0.69287800  1
  O  O36  1  0.08970800  0.73391200  0.18441500  1
  O  O37  1  0.91145700  0.63849900  0.94356900  1
  O  O38  1  0.60608500  0.02336200  0.66686300  1
  O  O39  1  0.90736500  0.63735400  0.44387300  1
  O  O40  1  0.61240000  0.02870700  0.16907600  1
  O  O41  1  0.60682800  0.58019600  0.57680000  1
  O  O42  1  0.60512700  0.57934000  0.07786200  1
  O  O43  1  0.32263800  0.07059700  0.54039800  1
  O  O44  1  0.32392000  0.06912100  0.04155200  1
  O  O45  1  0.32650100  0.25809600  0.70131700  1
  O  O46  1  0.33038700  0.25521600  0.20815200  1
