# generated using pymatgen
data_Li6Mn5Fe(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18330700
_cell_length_b   8.27969200
_cell_length_c   14.31593498
_cell_angle_alpha   89.96303132
_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   377.32217803
_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  0.70748300  0.00880400  1
  Li  Li1  1  0.50000000  0.66072100  0.64150500  1
  Li  Li2  1  0.50000000  0.63469700  0.34976400  1
  Li  Li3  1  0.50000000  0.20716500  0.50873100  1
  Li  Li4  1  0.50000000  0.15895600  0.14227700  1
  Li  Li5  1  0.50000000  0.13294700  0.84906900  1
  Mn  Mn6  1  0.00000000  0.82632900  0.18602800  1
  Mn  Mn7  1  0.00000000  0.80862500  0.82013600  1
  Mn  Mn8  1  0.00000000  0.36528200  0.99417900  1
  Mn  Mn9  1  0.00000000  0.32573800  0.68590700  1
  Mn  Mn10  1  0.00000000  0.30791300  0.32011800  1
  Fe  Fe11  1  0.00000000  0.86214700  0.49596300  1
  B  B12  1  0.50000000  0.99931700  0.33482600  1
  B  B13  1  0.00000000  0.99999300  0.00002900  1
  B  B14  1  0.50000000  0.99890000  0.66547700  1
  B  B15  1  0.50000000  0.50019200  0.83313900  1
  B  B16  1  0.00000000  0.50102100  0.49930800  1
  B  B17  1  0.50000000  0.50010900  0.16668800  1
  O  O18  1  0.50000000  0.98694600  0.56859800  1
  O  O19  1  0.50000000  0.98475800  0.23765500  1
  O  O20  1  0.50000000  0.86274500  0.39130300  1
  O  O21  1  0.50000000  0.86013100  0.72001600  1
  O  O22  1  0.00000000  0.84567500  0.03912800  1
  O  O23  1  0.50000000  0.65223900  0.87457300  1
  O  O24  1  0.50000000  0.65025800  0.20985500  1
  O  O25  1  0.00000000  0.63896000  0.55598800  1
  O  O26  1  0.00000000  0.51847600  0.40272900  1
  O  O27  1  0.50000000  0.48969800  0.06979800  1
  O  O28  1  0.50000000  0.48609000  0.73611600  1
  O  O29  1  0.50000000  0.36182900  0.88850100  1
  O  O30  1  0.50000000  0.36016300  0.22016700  1
  O  O31  1  0.00000000  0.34775500  0.53948000  1
  O  O32  1  0.50000000  0.15276600  0.37499900  1
  O  O33  1  0.50000000  0.14963300  0.70829800  1
  O  O34  1  0.00000000  0.13572300  0.05773200  1
  O  O35  1  0.00000000  0.01862500  0.90311500  1
