# generated using pymatgen
data_Li4Mn3Fe(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17509600
_cell_length_b   6.25005472
_cell_length_c   8.07214455
_cell_angle_alpha   78.39409844
_cell_angle_beta   88.80720771
_cell_angle_gamma   87.69620077
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Fe(BO3)4
_chemical_formula_sum   'Li4 Mn3 Fe1 B4 O12'
_cell_volume   255.52410548
_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  0.91656800  0.52177600  0.15056800  1
  Li  Li1  1  0.41519000  0.01983300  0.65148600  1
  Li  Li2  1  0.58382900  0.97908000  0.34707000  1
  Li  Li3  1  0.08513300  0.48202500  0.84947600  1
  Mn  Mn4  1  0.90369000  0.25618000  0.50954500  1
  Mn  Mn5  1  0.09548800  0.74391600  0.49101400  1
  Mn  Mn6  1  0.59533000  0.24227700  0.98955800  1
  Fe  Fe7  1  0.41117600  0.75451000  0.01168500  1
  B  B8  1  0.09772600  0.09298000  0.16677500  1
  B  B9  1  0.39980700  0.40790200  0.33122000  1
  B  B10  1  0.59758900  0.59478000  0.66840600  1
  B  B11  1  0.90331800  0.90314700  0.83420900  1
  O  O12  1  0.98986900  0.25493600  0.04207500  1
  O  O13  1  0.95721200  0.01079700  0.31331600  1
  O  O14  1  0.35537200  0.01965300  0.15061100  1
  O  O15  1  0.53921200  0.49551700  0.18478100  1
  O  O16  1  0.50956100  0.24635400  0.45482100  1
  O  O17  1  0.14212900  0.47898800  0.34786500  1
  O  O18  1  0.85531900  0.52106500  0.65286200  1
  O  O19  1  0.49094700  0.75574300  0.54239600  1
  O  O20  1  0.45595700  0.51035600  0.81347900  1
  O  O21  1  0.64208300  0.97105000  0.84994500  1
  O  O22  1  0.04093900  0.99016400  0.68745300  1
  O  O23  1  0.01655600  0.74697000  0.95938200  1
