# generated using pymatgen
data_Li2Fe2B2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.12774400
_cell_length_b   5.28990300
_cell_length_c   9.45928320
_cell_angle_alpha   56.51694639
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe2B2O7
_chemical_formula_sum   'Li8 Fe8 B8 O28'
_cell_volume   506.14801775
_cell_formula_units_Z   4
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  0.34125700  0.72910700  0.12640700  1
  Li  Li1  1  0.74546000  0.01402600  0.18172000  1
  Li  Li2  1  0.24546000  0.98597400  0.31828000  1
  Li  Li3  1  0.84125700  0.27089300  0.37359300  1
  Li  Li4  1  0.15874300  0.72910700  0.62640700  1
  Li  Li5  1  0.75454000  0.01402600  0.68172000  1
  Li  Li6  1  0.25454000  0.98597400  0.81828000  1
  Li  Li7  1  0.65874300  0.27089300  0.87359300  1
  Fe  Fe8  1  0.09480700  0.55164700  0.10578300  1
  Fe  Fe9  1  0.48833600  0.18596200  0.19704600  1
  Fe  Fe10  1  0.98833600  0.81403800  0.30295400  1
  Fe  Fe11  1  0.59480700  0.44835300  0.39421700  1
  Fe  Fe12  1  0.40519300  0.55164700  0.60578300  1
  Fe  Fe13  1  0.01166400  0.18596200  0.69704600  1
  Fe  Fe14  1  0.51166400  0.81403800  0.80295400  1
  Fe  Fe15  1  0.90519300  0.44835300  0.89421700  1
  B  B16  1  0.88140000  0.77970000  0.02948000  1
  B  B17  1  0.67822400  0.62622100  0.04190000  1
  B  B18  1  0.17822400  0.37377900  0.45810000  1
  B  B19  1  0.38140000  0.22030000  0.47052000  1
  B  B20  1  0.61860000  0.77970000  0.52948000  1
  B  B21  1  0.82177600  0.62622100  0.54190000  1
  B  B22  1  0.32177600  0.37377900  0.95810000  1
  B  B23  1  0.11860000  0.22030000  0.97052000  1
  O  O24  1  0.79932500  0.56701800  0.03091200  1
  O  O25  1  0.16469500  0.93948900  0.01044800  1
  O  O26  1  0.03284300  0.19654900  0.09747100  1
  O  O27  1  0.61834800  0.35606000  0.06300400  1
  O  O28  1  0.35821400  0.09844000  0.12356200  1
  O  O29  1  0.66308500  0.67179900  0.17967700  1
  O  O30  1  0.94478200  0.60754900  0.19527700  1
  O  O31  1  0.44478200  0.39245100  0.30472300  1
  O  O32  1  0.16308500  0.32820100  0.32032300  1
  O  O33  1  0.85821400  0.90156000  0.37643800  1
  O  O34  1  0.11834800  0.64394000  0.43699600  1
  O  O35  1  0.53284300  0.80345100  0.40252900  1
  O  O36  1  0.66469500  0.06051100  0.48955200  1
  O  O37  1  0.29932500  0.43298200  0.46908800  1
  O  O38  1  0.70067500  0.56701800  0.53091200  1
  O  O39  1  0.33530500  0.93948900  0.51044800  1
  O  O40  1  0.46715700  0.19654900  0.59747100  1
  O  O41  1  0.88165200  0.35606000  0.56300400  1
  O  O42  1  0.14178600  0.09844000  0.62356300  1
  O  O43  1  0.83691500  0.67179900  0.67967700  1
  O  O44  1  0.55521800  0.60754900  0.69527700  1
  O  O45  1  0.05521800  0.39245100  0.80472300  1
  O  O46  1  0.33691500  0.32820100  0.82032300  1
  O  O47  1  0.64178600  0.90156000  0.87643700  1
  O  O48  1  0.38165200  0.64394000  0.93699600  1
  O  O49  1  0.96715700  0.80345100  0.90252900  1
  O  O50  1  0.83530500  0.06051100  0.98955200  1
  O  O51  1  0.20067500  0.43298200  0.96908800  1
