# generated using pymatgen
data_Li3Fe8(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23573600
_cell_length_b   9.10743579
_cell_length_c   10.18203326
_cell_angle_alpha   89.58783770
_cell_angle_beta   89.24255857
_cell_angle_gamma   89.58683479
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe8(BO3)8
_chemical_formula_sum   'Li3 Fe8 B8 O24'
_cell_volume   485.45411150
_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  0.14842600  0.17895600  0.66336500  1
  Li  Li1  1  0.18697800  0.16975700  0.15967400  1
  Li  Li2  1  0.33016500  0.33469100  0.39889200  1
  Fe  Fe3  1  0.16165800  0.83014500  0.62922400  1
  Fe  Fe4  1  0.18296900  0.50554000  0.12561200  1
  Fe  Fe5  1  0.32993400  0.99210600  0.87799500  1
  Fe  Fe6  1  0.33276100  0.66936900  0.37434300  1
  Fe  Fe7  1  0.65430500  0.34941300  0.63043300  1
  Fe  Fe8  1  0.66967800  0.99632900  0.13014900  1
  Fe  Fe9  1  0.83041100  0.15397000  0.38459900  1
  Fe  Fe10  1  0.83023200  0.49806200  0.88300800  1
  B  B11  1  0.15157200  0.49849700  0.62250600  1
  B  B12  1  0.16282400  0.83683400  0.13152400  1
  B  B13  1  0.34096400  0.99860900  0.37692300  1
  B  B14  1  0.33539700  0.66531800  0.87606100  1
  B  B15  1  0.67212500  0.00435300  0.63365200  1
  B  B16  1  0.67850700  0.32265500  0.12545300  1
  B  B17  1  0.82755800  0.49648800  0.37521300  1
  B  B18  1  0.81981100  0.16649400  0.87623400  1
  O  O19  1  0.09322500  0.49900900  0.34472200  1
  O  O20  1  0.07817200  0.14101700  0.85731600  1
  O  O21  1  0.22211300  0.79739800  0.82736400  1
  O  O22  1  0.24008900  0.87137400  0.43453300  1
  O  O23  1  0.20644900  0.12798800  0.36984600  1
  O  O24  1  0.17520400  0.55799500  0.92374700  1
  O  O25  1  0.27984000  0.36749800  0.60199100  1
  O  O26  1  0.30567200  0.95949700  0.08149000  1
  O  O27  1  0.25752700  0.63086100  0.57550400  1
  O  O28  1  0.29256300  0.71762100  0.18250600  1
  O  O29  1  0.42052100  0.32600900  0.14400300  1
  O  O30  1  0.40596000  0.00473800  0.67074100  1
  O  O31  1  0.58337500  0.99200200  0.32180900  1
  O  O32  1  0.59051600  0.65154800  0.87654400  1
  O  O33  1  0.70851000  0.29730300  0.84080800  1
  O  O34  1  0.71747600  0.36455300  0.41622500  1
  O  O35  1  0.67994100  0.61961000  0.36774600  1
  O  O36  1  0.66752700  0.05326100  0.92857000  1
  O  O37  1  0.82109800  0.43884200  0.07679200  1
  O  O38  1  0.81335900  0.87914600  0.63897200  1
  O  O39  1  0.78213700  0.13547100  0.59393600  1
  O  O40  1  0.81685300  0.19243000  0.16040800  1
  O  O41  1  0.90674300  0.84509800  0.12622000  1
  O  O42  1  0.91771700  0.50225400  0.68474500  1
