# generated using pymatgen
data_LiFe4(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29790700
_cell_length_b   8.99263864
_cell_length_c   11.34655320
_cell_angle_alpha   113.26723327
_cell_angle_beta   102.87403052
_cell_angle_gamma   89.60137595
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe4(BO3)4
_chemical_formula_sum   'Li2 Fe8 B8 O24'
_cell_volume   482.14012413
_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  0.60199800  0.94641000  0.90697000  1
  Li  Li1  1  0.68235700  0.33453500  0.65692500  1
  Fe  Fe2  1  0.40104100  0.72926400  0.12978000  1
  Fe  Fe3  1  0.09673200  0.77530700  0.87819700  1
  Fe  Fe4  1  0.85345800  0.85388800  0.37854500  1
  Fe  Fe5  1  0.65101500  0.65434400  0.62640900  1
  Fe  Fe6  1  0.35124900  0.35151000  0.37694100  1
  Fe  Fe7  1  0.15443800  0.14784000  0.62482500  1
  Fe  Fe8  1  0.90468300  0.23125800  0.13171300  1
  Fe  Fe9  1  0.59045300  0.27481900  0.87774000  1
  B  B10  1  0.65464900  0.98549900  0.62983200  1
  B  B11  1  0.89378600  0.89394600  0.12794200  1
  B  B12  1  0.13479200  0.48412200  0.62408000  1
  B  B13  1  0.39421600  0.39453400  0.12838900  1
  B  B14  1  0.85404300  0.51762500  0.37638900  1
  B  B15  1  0.59336700  0.60733800  0.87372000  1
  B  B16  1  0.35609500  0.01588700  0.37516400  1
  B  B17  1  0.11448400  0.11152500  0.88235000  1
  O  O18  1  0.12192800  0.85342600  0.08897100  1
  O  O19  1  0.47226100  0.87051100  0.33141600  1
  O  O20  1  0.23796200  0.98115000  0.88527500  1
  O  O21  1  0.54405500  0.85883100  0.64384200  1
  O  O22  1  0.85980400  0.96966900  0.57098000  1
  O  O23  1  0.77921400  0.79823200  0.17580900  1
  O  O24  1  0.29335800  0.53259000  0.13374400  1
  O  O25  1  0.02577300  0.63211300  0.66345100  1
  O  O26  1  0.69258000  0.71474600  0.82857300  1
  O  O27  1  0.63353600  0.51993000  0.42735400  1
  O  O28  1  0.95282800  0.64895800  0.36928500  1
  O  O29  1  0.39551800  0.65357100  0.93719900  1
  O  O30  1  0.61629700  0.34574100  0.07756500  1
  O  O31  1  0.37436700  0.47498600  0.58304800  1
  O  O32  1  0.28458000  0.29022900  0.17373300  1
  O  O33  1  0.96679300  0.36752000  0.33136900  1
  O  O34  1  0.68852600  0.45853300  0.84871300  1
  O  O35  1  0.21766700  0.22041200  0.84206700  1
  O  O36  1  0.13086300  0.01732700  0.41738300  1
  O  O37  1  0.46625800  0.15751100  0.38146500  1
  O  O38  1  0.01792600  0.35125300  0.62355900  1
  O  O39  1  0.77646000  0.02428900  0.11021500  1
  O  O40  1  0.56032600  0.14005600  0.67945800  1
  O  O41  1  0.87510900  0.14325400  0.92354500  1
