# generated using pymatgen
data_Li2MnFe(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16563100
_cell_length_b   8.25522900
_cell_length_c   14.29695623
_cell_angle_alpha   89.97627530
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnFe(BO3)2
_chemical_formula_sum   'Li6 Mn3 Fe3 B6 O18'
_cell_volume   373.62245132
_cell_formula_units_Z   3
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  0.50000000  0.70718400  0.01017400  1
  Li  Li1  1  0.50000000  0.66068800  0.64080200  1
  Li  Li2  1  0.50000000  0.63450500  0.34925100  1
  Li  Li3  1  0.50000000  0.20678600  0.50692500  1
  Li  Li4  1  0.50000000  0.15807400  0.14368000  1
  Li  Li5  1  0.50000000  0.13289100  0.84930700  1
  Mn  Mn6  1  0.00000000  0.80864600  0.82017800  1
  Mn  Mn7  1  0.00000000  0.36565400  0.99479900  1
  Mn  Mn8  1  0.00000000  0.32570600  0.68563400  1
  Fe  Fe9  1  0.00000000  0.86356200  0.49510300  1
  Fe  Fe10  1  0.00000000  0.82433700  0.18386500  1
  Fe  Fe11  1  0.00000000  0.31225300  0.32044500  1
  B  B12  1  0.50000000  0.99972200  0.33320500  1
  B  B13  1  0.00000000  0.00050500  0.00123000  1
  B  B14  1  0.50000000  0.99889600  0.66546500  1
  B  B15  1  0.50000000  0.50014200  0.83332200  1
  B  B16  1  0.00000000  0.49984700  0.49885900  1
  B  B17  1  0.50000000  0.50079100  0.16782400  1
  O  O18  1  0.50000000  0.98818300  0.56850300  1
  O  O19  1  0.50000000  0.98078800  0.23643400  1
  O  O20  1  0.50000000  0.86367400  0.39112100  1
  O  O21  1  0.50000000  0.85922500  0.71947900  1
  O  O22  1  0.00000000  0.84666900  0.04162700  1
  O  O23  1  0.50000000  0.65217300  0.87542200  1
  O  O24  1  0.50000000  0.65245400  0.21002500  1
  O  O25  1  0.00000000  0.63871800  0.55453200  1
  O  O26  1  0.00000000  0.51461100  0.40194700  1
  O  O27  1  0.50000000  0.48919600  0.07095000  1
  O  O28  1  0.50000000  0.48713100  0.73625800  1
  O  O29  1  0.50000000  0.36128700  0.88831900  1
  O  O30  1  0.50000000  0.36098000  0.22209000  1
  O  O31  1  0.00000000  0.34695000  0.53957700  1
  O  O32  1  0.50000000  0.15434500  0.37219100  1
  O  O33  1  0.50000000  0.14923600  0.70898900  1
  O  O34  1  0.00000000  0.13672700  0.05828300  1
  O  O35  1  0.00000000  0.01746500  0.90419000  1
