# generated using pymatgen
data_Li6Mn5Fe(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18374000
_cell_length_b   8.27155300
_cell_length_c   14.33027345
_cell_angle_alpha   89.90086775
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Mn5Fe(BO3)6
_chemical_formula_sum   'Li6 Mn5 Fe1 B6 O18'
_cell_volume   377.37965083
_cell_formula_units_Z   1
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  0.70737000  0.99036700  1
  Li  Li1  1  0.50000000  0.65939300  0.35820800  1
  Li  Li2  1  0.50000000  0.63354500  0.65102500  1
  Li  Li3  1  0.50000000  0.20707200  0.49177200  1
  Li  Li4  1  0.50000000  0.15853200  0.85731300  1
  Li  Li5  1  0.50000000  0.13286400  0.15043200  1
  Mn  Mn6  1  0.00000000  0.86501600  0.50627400  1
  Mn  Mn7  1  0.00000000  0.80800500  0.17997000  1
  Mn  Mn8  1  0.00000000  0.36592400  0.00558200  1
  Mn  Mn9  1  0.00000000  0.32640300  0.31469500  1
  Mn  Mn10  1  0.00000000  0.30841000  0.67979300  1
  Fe  Fe11  1  0.00000000  0.82473400  0.81672800  1
  B  B12  1  0.50000000  0.99829300  0.66776300  1
  B  B13  1  0.00000000  0.00043700  0.99900300  1
  B  B14  1  0.50000000  0.99998000  0.33337000  1
  B  B15  1  0.50000000  0.50007000  0.16647500  1
  B  B16  1  0.00000000  0.50003900  0.50010900  1
  B  B17  1  0.50000000  0.50217300  0.83325600  1
  O  O18  1  0.50000000  0.98945400  0.43001900  1
  O  O19  1  0.50000000  0.98184500  0.76430400  1
  O  O20  1  0.50000000  0.86136400  0.61113100  1
  O  O21  1  0.50000000  0.86012700  0.27971000  1
  O  O22  1  0.00000000  0.84659700  0.95840000  1
  O  O23  1  0.50000000  0.65258000  0.12490800  1
  O  O24  1  0.50000000  0.65362100  0.79087500  1
  O  O25  1  0.00000000  0.63577900  0.44219500  1
  O  O26  1  0.00000000  0.51881700  0.59678600  1
  O  O27  1  0.50000000  0.49007800  0.92997500  1
  O  O28  1  0.50000000  0.48620100  0.26332400  1
  O  O29  1  0.50000000  0.36183100  0.11117100  1
  O  O30  1  0.50000000  0.36259200  0.77944600  1
  O  O31  1  0.00000000  0.34542200  0.46119200  1
  O  O32  1  0.50000000  0.15141600  0.62658700  1
  O  O33  1  0.50000000  0.15036900  0.29003900  1
  O  O34  1  0.00000000  0.13673800  0.94204400  1
  O  O35  1  0.00000000  0.01690800  0.09576300  1
