# generated using pymatgen
data_Li3Fe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24686300
_cell_length_b   5.25396078
_cell_length_c   20.27961704
_cell_angle_alpha   89.98070386
_cell_angle_beta   91.39106035
_cell_angle_gamma   119.83720918
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe4(BO3)4
_chemical_formula_sum   'Li6 Fe8 B8 O24'
_cell_volume   484.75152803
_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  0.32489900  0.34343000  0.91887100  1
  Li  Li1  1  0.34716300  0.32608200  0.16962100  1
  Li  Li2  1  0.32972800  0.35205100  0.41878500  1
  Li  Li3  1  0.65839600  0.64950200  0.79026700  1
  Li  Li4  1  0.65894800  0.66160800  0.54644000  1
  Li  Li5  1  0.65685900  0.66849500  0.04769500  1
  Fe  Fe6  1  0.32346200  0.99847200  0.80898100  1
  Fe  Fe7  1  0.32492100  0.98797300  0.30840300  1
  Fe  Fe8  1  0.99233400  0.67374400  0.93512100  1
  Fe  Fe9  1  0.99616700  0.68371700  0.43455900  1
  Fe  Fe10  1  0.01062800  0.32379200  0.56084100  1
  Fe  Fe11  1  0.99378600  0.32432200  0.05953600  1
  Fe  Fe12  1  0.67022000  0.00753800  0.68237500  1
  Fe  Fe13  1  0.67898900  0.99135400  0.18683400  1
  B  B14  1  0.66239300  0.00094300  0.93640400  1
  B  B15  1  0.66697600  0.00782800  0.43620100  1
  B  B16  1  0.99537600  0.33316600  0.81018500  1
  B  B17  1  0.99287600  0.32833400  0.31272700  1
  B  B18  1  0.00064400  0.66681300  0.68588200  1
  B  B19  1  0.99991800  0.65827300  0.18595500  1
  B  B20  1  0.33290400  0.99528900  0.56094900  1
  B  B21  1  0.32860400  0.99686700  0.06156800  1
  O  O22  1  0.74643500  0.07303400  0.78737800  1
  O  O23  1  0.72482000  0.09722400  0.29101700  1
  O  O24  1  0.93038900  0.25450600  0.95082300  1
  O  O25  1  0.41529200  0.01912200  0.91663300  1
  O  O26  1  0.92883700  0.26272100  0.45254000  1
  O  O27  1  0.42166700  0.02653400  0.41347700  1
  O  O28  1  0.96849600  0.57738500  0.82549500  1
  O  O29  1  0.35599300  0.26524000  0.55767300  1
  O  O30  1  0.01818100  0.59761600  0.32896700  1
  O  O31  1  0.34264100  0.26671100  0.06761400  1
  O  O32  1  0.26443000  0.34649100  0.81849300  1
  O  O33  1  0.23381900  0.29245600  0.32049400  1
  O  O34  1  0.75461600  0.69522100  0.69018400  1
  O  O35  1  0.73465500  0.64748800  0.18147300  1
  O  O36  1  0.64137900  0.72774600  0.94282000  1
  O  O37  1  0.97684500  0.40237700  0.66648000  1
  O  O38  1  0.64484700  0.73606200  0.44458800  1
  O  O39  1  0.02752400  0.41660700  0.16909200  1
  O  O40  1  0.58058800  0.96919300  0.58160500  1
  O  O41  1  0.57947100  0.97864100  0.07723800  1
  O  O42  1  0.07334300  0.74092000  0.54280400  1
  O  O43  1  0.06806600  0.74653200  0.04196500  1
  O  O44  1  0.27457900  0.90145400  0.70395400  1
  O  O45  1  0.25394500  0.92373900  0.20747100  1
