# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24304500
_cell_length_b   6.02796083
_cell_length_c   16.18618086
_cell_angle_alpha   81.78649474
_cell_angle_beta   88.77683675
_cell_angle_gamma   89.19914899
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   506.16859651
_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  0.84619500  0.06490900  0.38922400  1
  Li  Li1  1  0.15154700  0.43601800  0.10921100  1
  Li  Li2  1  0.65200800  0.18775000  0.86008000  1
  Li  Li3  1  0.35066100  0.31186200  0.64045000  1
  Li  Li4  1  0.65147600  0.68853600  0.35876600  1
  Li  Li5  1  0.34815200  0.81343400  0.14023900  1
  Li  Li6  1  0.84693100  0.56356500  0.88993800  1
  Li  Li7  1  0.15119100  0.93473900  0.61054400  1
  Mn  Mn8  1  0.16715600  0.02332100  0.78968300  1
  Mn  Mn9  1  0.33144500  0.22427600  0.46117100  1
  Mn  Mn10  1  0.16726000  0.52472200  0.29063200  1
  Mn  Mn11  1  0.66936800  0.77259600  0.54149900  1
  Mn  Mn12  1  0.33157000  0.72386700  0.96048600  1
  Fe  Fe13  1  0.66701400  0.27203600  0.04316500  1
  Fe  Fe14  1  0.83811000  0.47274500  0.71055100  1
  Fe  Fe15  1  0.83771500  0.97257600  0.20858600  1
  B  B16  1  0.32703000  0.03678000  0.29616400  1
  B  B17  1  0.82871400  0.28370100  0.54907100  1
  B  B18  1  0.67021700  0.46312800  0.20185900  1
  B  B19  1  0.17218100  0.21649400  0.95291100  1
  B  B20  1  0.82807400  0.78690000  0.04804200  1
  B  B21  1  0.32749300  0.53628000  0.79596000  1
  B  B22  1  0.17136700  0.71656000  0.45231700  1
  B  B23  1  0.67309400  0.96406700  0.70303800  1
  O  O24  1  0.58618700  0.01199900  0.30812300  1
  O  O25  1  0.18015100  0.17032500  0.34364000  1
  O  O26  1  0.71416000  0.16818400  0.49144500  1
  O  O27  1  0.29670100  0.33180900  0.00885200  1
  O  O28  1  0.78652500  0.08311400  0.75991800  1
  O  O29  1  0.81840700  0.32676900  0.15484100  1
  O  O30  1  0.31884300  0.08042300  0.90608100  1
  O  O31  1  0.08741500  0.26121100  0.56351500  1
  O  O32  1  0.41140900  0.48744000  0.18784800  1
  O  O33  1  0.91213900  0.24080600  0.94082400  1
  O  O34  1  0.67928600  0.41961500  0.59513400  1
  O  O35  1  0.20738900  0.42172200  0.73846200  1
  O  O36  1  0.78736000  0.57901500  0.25886100  1
  O  O37  1  0.32222900  0.58021200  0.40674300  1
  O  O38  1  0.08642400  0.76251900  0.06304800  1
  O  O39  1  0.58647200  0.51140700  0.80879300  1
  O  O40  1  0.91283400  0.73950600  0.43730700  1
  O  O41  1  0.67756800  0.92081200  0.09512700  1
  O  O42  1  0.17956800  0.66906600  0.84339000  1
  O  O43  1  0.20446800  0.92250800  0.23921200  1
  O  O44  1  0.71359900  0.67344400  0.98997500  1
  O  O45  1  0.28698200  0.83346400  0.50946700  1
  O  O46  1  0.82349400  0.82689400  0.65792500  1
  O  O47  1  0.41442100  0.98687400  0.68788100  1
