# generated using pymatgen
data_Li6MnFe5(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13955900
_cell_length_b   8.24405500
_cell_length_c   14.29396137
_cell_angle_alpha   89.89862775
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6MnFe5(BO3)6
_chemical_formula_sum   'Li6 Mn1 Fe5 B6 O18'
_cell_volume   369.96569310
_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  0.70728900  0.00905500  1
  Li  Li1  1  0.50000000  0.65979800  0.64165200  1
  Li  Li2  1  0.50000000  0.63500200  0.34876400  1
  Li  Li3  1  0.50000000  0.20612900  0.50689500  1
  Li  Li4  1  0.50000000  0.15905600  0.14266000  1
  Li  Li5  1  0.50000000  0.13377400  0.84966800  1
  Mn  Mn6  1  0.00000000  0.32601600  0.68616900  1
  Fe  Fe7  1  0.00000000  0.86278100  0.49568700  1
  Fe  Fe8  1  0.00000000  0.82408400  0.18434400  1
  Fe  Fe9  1  0.00000000  0.81186900  0.81995900  1
  Fe  Fe10  1  0.00000000  0.36447200  0.99661700  1
  Fe  Fe11  1  0.00000000  0.31247200  0.31989100  1
  B  B12  1  0.50000000  0.00016000  0.33303900  1
  B  B13  1  0.00000000  0.99983100  0.00008900  1
  B  B14  1  0.50000000  0.99776200  0.66656400  1
  B  B15  1  0.50000000  0.50234200  0.83494000  1
  B  B16  1  0.00000000  0.49902100  0.49867900  1
  B  B17  1  0.50000000  0.50018500  0.16669400  1
  O  O18  1  0.50000000  0.98746000  0.56933100  1
  O  O19  1  0.50000000  0.98183600  0.23612600  1
  O  O20  1  0.50000000  0.86360300  0.39085200  1
  O  O21  1  0.50000000  0.85721000  0.72063600  1
  O  O22  1  0.00000000  0.84798600  0.04278000  1
  O  O23  1  0.50000000  0.65612000  0.87480600  1
  O  O24  1  0.50000000  0.65174900  0.20933600  1
  O  O25  1  0.00000000  0.63786700  0.55441300  1
  O  O26  1  0.00000000  0.51417400  0.40162100  1
  O  O27  1  0.50000000  0.48876300  0.06954200  1
  O  O28  1  0.50000000  0.48681800  0.73770300  1
  O  O29  1  0.50000000  0.36399800  0.89122900  1
  O  O30  1  0.50000000  0.35991000  0.22087500  1
  O  O31  1  0.00000000  0.34604000  0.53969500  1
  O  O32  1  0.50000000  0.15475600  0.37224100  1
  O  O33  1  0.50000000  0.14816000  0.70999500  1
  O  O34  1  0.00000000  0.13958500  0.05459100  1
  O  O35  1  0.00000000  0.01192400  0.90286200  1
