# generated using pymatgen
data_Li3Fe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25038000
_cell_length_b   9.03181700
_cell_length_c   10.21909619
_cell_angle_alpha   89.07765204
_cell_angle_beta   89.19928150
_cell_angle_gamma   89.65053217
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4(BO3)4
_chemical_formula_sum   'Li6 Fe8 B8 O24'
_cell_volume   484.47589069
_cell_formula_units_Z   2
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  0.18074900  0.16198800  0.15752900  1
  Li  Li1  1  0.31806700  0.32819300  0.42104200  1
  Li  Li2  1  0.33975000  0.32526700  0.90450000  1
  Li  Li3  1  0.65151800  0.67735400  0.66561800  1
  Li  Li4  1  0.68687100  0.66342600  0.16296100  1
  Li  Li5  1  0.82488400  0.83398100  0.40377700  1
  Fe  Fe6  1  0.14687900  0.84657600  0.63390100  1
  Fe  Fe7  1  0.18262000  0.50000100  0.13300000  1
  Fe  Fe8  1  0.32333600  0.98975600  0.88041900  1
  Fe  Fe9  1  0.33670000  0.66689500  0.38419600  1
  Fe  Fe10  1  0.67888000  0.33340000  0.63182400  1
  Fe  Fe11  1  0.68196600  0.99444200  0.12424000  1
  Fe  Fe12  1  0.83389600  0.15865400  0.37829900  1
  Fe  Fe13  1  0.83532400  0.50817000  0.88838700  1
  B  B14  1  0.17681000  0.50535800  0.62636700  1
  B  B15  1  0.17326700  0.82927200  0.12844300  1
  B  B16  1  0.33221600  0.99927600  0.37431100  1
  B  B17  1  0.32840500  0.66367700  0.87372100  1
  B  B18  1  0.65017500  0.99827500  0.62938300  1
  B  B19  1  0.67094200  0.33081400  0.12631300  1
  B  B20  1  0.83613800  0.49620300  0.38165000  1
  B  B21  1  0.82633700  0.16699100  0.87668000  1
  O  O22  1  0.09355100  0.48435500  0.35085400  1
  O  O23  1  0.08742500  0.15965000  0.88432100  1
  O  O24  1  0.18774500  0.79351700  0.85043800  1
  O  O25  1  0.19654100  0.87618700  0.41826800  1
  O  O26  1  0.21148900  0.13470100  0.35852700  1
  O  O27  1  0.20462100  0.53403800  0.91542800  1
  O  O28  1  0.31868700  0.37567400  0.62404900  1
  O  O29  1  0.29430400  0.96005100  0.08341600  1
  O  O30  1  0.29436500  0.63794600  0.59713500  1
  O  O31  1  0.32138900  0.70764300  0.16560200  1
  O  O32  1  0.40940200  0.32120200  0.11040300  1
  O  O33  1  0.41024300  0.99971500  0.68705200  1
  O  O34  1  0.58920200  0.98687100  0.34254600  1
  O  O35  1  0.58300400  0.66379500  0.85204400  1
  O  O36  1  0.70220500  0.29702800  0.83059700  1
  O  O37  1  0.70147600  0.37108500  0.42778900  1
  O  O38  1  0.71064100  0.62931000  0.36554900  1
  O  O39  1  0.67335000  0.05166400  0.91919100  1
  O  O40  1  0.79303800  0.46442400  0.09791700  1
  O  O41  1  0.77542300  0.86749100  0.60559100  1
  O  O42  1  0.76182000  0.13139700  0.58938200  1
  O  O43  1  0.80943800  0.20764100  0.16626100  1
  O  O44  1  0.91473200  0.82386200  0.13958500  1
  O  O45  1  0.91438500  0.50193300  0.65453100  1
