# generated using pymatgen
data_Li3MnFe2(BO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.14540600
_cell_length_b   8.25182500
_cell_length_c   14.31751398
_cell_angle_alpha   89.97877847
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnFe2(BO3)3
_chemical_formula_sum   'Li6 Mn2 Fe4 B6 O18'
_cell_volume   371.61591595
_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  0.50000000  0.70708200  0.00895800  1
  Li  Li1  1  0.50000000  0.65861800  0.64278000  1
  Li  Li2  1  0.50000000  0.63295200  0.34803700  1
  Li  Li3  1  0.50000000  0.20587200  0.50690400  1
  Li  Li4  1  0.50000000  0.16017600  0.14208400  1
  Li  Li5  1  0.50000000  0.13448800  0.85008200  1
  Mn  Mn6  1  0.00000000  0.86497000  0.49396900  1
  Mn  Mn7  1  0.00000000  0.32576200  0.68568400  1
  Fe  Fe8  1  0.00000000  0.82410500  0.18352500  1
  Fe  Fe9  1  0.00000000  0.81239000  0.82066100  1
  Fe  Fe10  1  0.00000000  0.36405300  0.99619100  1
  Fe  Fe11  1  0.00000000  0.31327900  0.32049400  1
  B  B12  1  0.50000000  0.00071100  0.33136000  1
  B  B13  1  0.00000000  0.00047700  0.00013000  1
  B  B14  1  0.50000000  0.99877500  0.66809300  1
  B  B15  1  0.50000000  0.50202900  0.83479200  1
  B  B16  1  0.00000000  0.49782000  0.49993200  1
  B  B17  1  0.50000000  0.49988900  0.16640900  1
  O  O18  1  0.50000000  0.98907200  0.57092100  1
  O  O19  1  0.50000000  0.98245500  0.23463500  1
  O  O20  1  0.50000000  0.86264600  0.38822500  1
  O  O21  1  0.50000000  0.85779900  0.72154000  1
  O  O22  1  0.00000000  0.84852500  0.04255900  1
  O  O23  1  0.50000000  0.65628300  0.87431800  1
  O  O24  1  0.50000000  0.65200600  0.20861200  1
  O  O25  1  0.00000000  0.63497400  0.55649900  1
  O  O26  1  0.00000000  0.51442800  0.40247300  1
  O  O27  1  0.50000000  0.48773500  0.06957000  1
  O  O28  1  0.50000000  0.48575100  0.73775100  1
  O  O29  1  0.50000000  0.36470000  0.89140700  1
  O  O30  1  0.50000000  0.36065700  0.22122700  1
  O  O31  1  0.00000000  0.34431800  0.53931700  1
  O  O32  1  0.50000000  0.15383800  0.37155200  1
  O  O33  1  0.50000000  0.14868300  0.71141500  1
  O  O34  1  0.00000000  0.14000300  0.05469200  1
  O  O35  1  0.00000000  0.01267800  0.90320000  1
