# generated using pymatgen
data_Li6MnFe5(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13699300
_cell_length_b   8.24169300
_cell_length_c   14.29532045
_cell_angle_alpha   89.93771151
_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   369.59290129
_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  0.70628900  0.99242100  1
  Li  Li1  1  0.50000000  0.66000800  0.35805500  1
  Li  Li2  1  0.50000000  0.63512800  0.64983600  1
  Li  Li3  1  0.50000000  0.20663500  0.49203300  1
  Li  Li4  1  0.50000000  0.15691700  0.85623600  1
  Li  Li5  1  0.50000000  0.13287900  0.15148300  1
  Mn  Mn6  1  0.00000000  0.36652900  0.00575800  1
  Fe  Fe7  1  0.00000000  0.86442200  0.50415800  1
  Fe  Fe8  1  0.00000000  0.82342600  0.81624200  1
  Fe  Fe9  1  0.00000000  0.81329800  0.17993700  1
  Fe  Fe10  1  0.00000000  0.32379400  0.31635700  1
  Fe  Fe11  1  0.00000000  0.31235500  0.67978400  1
  B  B12  1  0.50000000  0.99975600  0.66655500  1
  B  B13  1  0.00000000  0.99887000  0.99896700  1
  B  B14  1  0.50000000  0.00012200  0.33342100  1
  B  B15  1  0.50000000  0.50095100  0.16865000  1
  B  B16  1  0.00000000  0.50014700  0.49974400  1
  B  B17  1  0.50000000  0.50081000  0.83213000  1
  O  O18  1  0.50000000  0.98889900  0.43048800  1
  O  O19  1  0.50000000  0.98112300  0.76319300  1
  O  O20  1  0.50000000  0.86380100  0.60871500  1
  O  O21  1  0.50000000  0.86048000  0.27933700  1
  O  O22  1  0.00000000  0.84558300  0.95776200  1
  O  O23  1  0.50000000  0.65410500  0.12796900  1
  O  O24  1  0.50000000  0.65124600  0.78844100  1
  O  O25  1  0.00000000  0.64023800  0.44550500  1
  O  O26  1  0.00000000  0.51199200  0.59679900  1
  O  O27  1  0.50000000  0.49132400  0.92885100  1
  O  O28  1  0.50000000  0.48331600  0.26541300  1
  O  O29  1  0.50000000  0.36268600  0.11211300  1
  O  O30  1  0.50000000  0.35958900  0.77886800  1
  O  O31  1  0.00000000  0.34856600  0.45735200  1
  O  O32  1  0.50000000  0.15468500  0.62717800  1
  O  O33  1  0.50000000  0.15126100  0.29065000  1
  O  O34  1  0.00000000  0.13652800  0.94333700  1
  O  O35  1  0.00000000  0.01224300  0.09626100  1
