# generated using pymatgen
data_Li2MnFe(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16511100
_cell_length_b   8.24376100
_cell_length_c   14.30912600
_cell_angle_alpha   89.84852712
_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   373.35840109
_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  0.70724300  0.99023800  1
  Li  Li1  1  0.50000000  0.65831200  0.35759400  1
  Li  Li2  1  0.50000000  0.63204300  0.65113300  1
  Li  Li3  1  0.50000000  0.20724000  0.49203700  1
  Li  Li4  1  0.50000000  0.15863600  0.85755300  1
  Li  Li5  1  0.50000000  0.13298300  0.15066600  1
  Mn  Mn6  1  0.00000000  0.86674500  0.50628300  1
  Mn  Mn7  1  0.00000000  0.80818100  0.17976600  1
  Mn  Mn8  1  0.00000000  0.36550000  0.00594500  1
  Fe  Fe9  1  0.00000000  0.82505100  0.81607900  1
  Fe  Fe10  1  0.00000000  0.32447800  0.31664900  1
  Fe  Fe11  1  0.00000000  0.31208100  0.68024000  1
  B  B12  1  0.50000000  0.00079600  0.66808100  1
  B  B13  1  0.00000000  0.00023200  0.99873200  1
  B  B14  1  0.50000000  0.00212900  0.33334500  1
  B  B15  1  0.50000000  0.49817800  0.16759100  1
  B  B16  1  0.00000000  0.49875300  0.49931400  1
  B  B17  1  0.50000000  0.50132100  0.83249700  1
  O  O18  1  0.50000000  0.99100100  0.43008800  1
  O  O19  1  0.50000000  0.98265600  0.76466900  1
  O  O20  1  0.50000000  0.86297200  0.61135400  1
  O  O21  1  0.50000000  0.86189700  0.27981500  1
  O  O22  1  0.00000000  0.84609100  0.95815300  1
  O  O23  1  0.50000000  0.65148000  0.12593200  1
  O  O24  1  0.50000000  0.65336500  0.79011600  1
  O  O25  1  0.00000000  0.63651300  0.44329800  1
  O  O26  1  0.00000000  0.51251800  0.59653400  1
  O  O27  1  0.50000000  0.48902200  0.92909200  1
  O  O28  1  0.50000000  0.48242800  0.26438500  1
  O  O29  1  0.50000000  0.36076000  0.11133100  1
  O  O30  1  0.50000000  0.36162400  0.77789500  1
  O  O31  1  0.00000000  0.34550100  0.45819200  1
  O  O32  1  0.50000000  0.15498600  0.62785900  1
  O  O33  1  0.50000000  0.15351300  0.29022300  1
  O  O34  1  0.00000000  0.13693900  0.94176200  1
  O  O35  1  0.00000000  0.01683100  0.09555900  1
