# generated using pymatgen
data_Li2MnFe(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16491300
_cell_length_b   8.26731800
_cell_length_c   14.27712626
_cell_angle_alpha   89.96777868
_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   373.56583528
_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  0.70801500  0.01003500  1
  Li  Li1  1  0.50000000  0.66000400  0.64155000  1
  Li  Li2  1  0.50000000  0.63501600  0.34918400  1
  Li  Li3  1  0.50000000  0.20706800  0.50812500  1
  Li  Li4  1  0.50000000  0.15902900  0.14239100  1
  Li  Li5  1  0.50000000  0.13405200  0.85003000  1
  Mn  Mn6  1  0.00000000  0.80775900  0.81992300  1
  Mn  Mn7  1  0.00000000  0.32583300  0.68588300  1
  Mn  Mn8  1  0.00000000  0.30772300  0.32001300  1
  Fe  Fe9  1  0.00000000  0.86245700  0.49571600  1
  Fe  Fe10  1  0.00000000  0.82392700  0.18382800  1
  Fe  Fe11  1  0.00000000  0.36445600  0.99613900  1
  B  B12  1  0.50000000  0.99717900  0.33361700  1
  B  B13  1  0.00000000  0.00246100  0.00024100  1
  B  B14  1  0.50000000  0.99881100  0.66554700  1
  B  B15  1  0.50000000  0.49946900  0.83493900  1
  B  B16  1  0.00000000  0.50129500  0.49907200  1
  B  B17  1  0.50000000  0.50067700  0.16568600  1
  O  O18  1  0.50000000  0.98816300  0.56831400  1
  O  O19  1  0.50000000  0.98053500  0.23643100  1
  O  O20  1  0.50000000  0.86141000  0.39115300  1
  O  O21  1  0.50000000  0.85918000  0.71947300  1
  O  O22  1  0.00000000  0.84971000  0.04208300  1
  O  O23  1  0.50000000  0.65250600  0.87587600  1
  O  O24  1  0.50000000  0.65216100  0.20827400  1
  O  O25  1  0.00000000  0.63894600  0.55592500  1
  O  O26  1  0.00000000  0.51867300  0.40223000  1
  O  O27  1  0.50000000  0.48884800  0.06849900  1
  O  O28  1  0.50000000  0.48563200  0.73753200  1
  O  O29  1  0.50000000  0.36194500  0.89098200  1
  O  O30  1  0.50000000  0.36135700  0.21976900  1
  O  O31  1  0.00000000  0.34774000  0.53925200  1
  O  O32  1  0.50000000  0.15100800  0.37385100  1
  O  O33  1  0.50000000  0.14906800  0.70906100  1
  O  O34  1  0.00000000  0.14085700  0.05600100  1
  O  O35  1  0.00000000  0.01702600  0.90337200  1
