# generated using pymatgen
data_Li4Mn3Fe(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24280600
_cell_length_b   6.05305522
_cell_length_c   8.27949606
_cell_angle_alpha   103.43523325
_cell_angle_beta   90.79996666
_cell_angle_gamma   90.73438950
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Fe(BO3)4
_chemical_formula_sum   'Li4 Mn3 Fe1 B4 O12'
_cell_volume   255.49937802
_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  0.65063300  0.95287800  0.28357100  1
  Li  Li1  1  0.84787900  0.54687000  0.21940100  1
  Li  Li2  1  0.14980500  0.45435600  0.78135900  1
  Li  Li3  1  0.34957100  0.04675800  0.71750600  1
  Mn  Mn4  1  0.66766800  0.68651200  0.91799500  1
  Mn  Mn5  1  0.33268500  0.31400300  0.07946700  1
  Mn  Mn6  1  0.16579900  0.18678200  0.42014900  1
  Fe  Fe7  1  0.83948100  0.81627900  0.58186100  1
  B  B8  1  0.16916300  0.83319500  0.09633300  1
  B  B9  1  0.33017400  0.66546000  0.40608900  1
  B  B10  1  0.66970400  0.33470500  0.59520300  1
  B  B11  1  0.83118200  0.16531700  0.90156900  1
  O  O12  1  0.90953300  0.82527400  0.12296200  1
  O  O13  1  0.68211700  0.98478700  0.80682700  1
  O  O14  1  0.20745200  0.83731300  0.51935100  1
  O  O15  1  0.58927700  0.67775100  0.38287700  1
  O  O16  1  0.18190200  0.48571800  0.31094900  1
  O  O17  1  0.71389400  0.33841800  0.01551100  1
  O  O18  1  0.28659300  0.65908200  0.98326400  1
  O  O19  1  0.81972800  0.51629800  0.68642300  1
  O  O20  1  0.41032900  0.32612900  0.62311200  1
  O  O21  1  0.78577200  0.15898000  0.48323900  1
  O  O22  1  0.31900800  0.01386100  0.18899400  1
  O  O23  1  0.09065100  0.17327400  0.87598900  1
