# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23504300
_cell_length_b   6.03604425
_cell_length_c   16.23099902
_cell_angle_alpha   82.07830994
_cell_angle_beta   88.93017181
_cell_angle_gamma   89.23768155
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   507.86991867
_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  0.84705300  0.06433000  0.38792500  1
  Li  Li1  1  0.15270900  0.43636100  0.11064300  1
  Li  Li2  1  0.65405400  0.18321300  0.86276000  1
  Li  Li3  1  0.34699200  0.31616800  0.63817900  1
  Li  Li4  1  0.65211100  0.68704600  0.35846800  1
  Li  Li5  1  0.34503400  0.81425000  0.14147300  1
  Li  Li6  1  0.84701500  0.56163500  0.89215700  1
  Li  Li7  1  0.15252400  0.93775700  0.60853800  1
  Mn  Mn8  1  0.17007300  0.02451100  0.78930700  1
  Mn  Mn9  1  0.16869000  0.52244800  0.29110300  1
  Mn  Mn10  1  0.82938100  0.47480200  0.71069300  1
  Mn  Mn11  1  0.66909100  0.77483500  0.53929100  1
  Mn  Mn12  1  0.33076700  0.72411800  0.96023900  1
  Fe  Fe13  1  0.66601000  0.27373400  0.04080800  1
  Fe  Fe14  1  0.32878700  0.22550400  0.46078700  1
  Fe  Fe15  1  0.83154900  0.97736600  0.20656700  1
  B  B16  1  0.32910300  0.03734900  0.29654700  1
  B  B17  1  0.82906200  0.28717200  0.54503900  1
  B  B18  1  0.67131400  0.46309300  0.20235700  1
  B  B19  1  0.17261500  0.21180300  0.95507200  1
  B  B20  1  0.82886800  0.78609400  0.04860100  1
  B  B21  1  0.32895800  0.53283700  0.79815900  1
  B  B22  1  0.17161000  0.71542800  0.45205500  1
  B  B23  1  0.67086000  0.96662200  0.70212800  1
  O  O24  1  0.58849000  0.01116400  0.30794700  1
  O  O25  1  0.18483000  0.16892900  0.34589200  1
  O  O26  1  0.70921300  0.17346200  0.48760900  1
  O  O27  1  0.29582300  0.32480000  0.01204200  1
  O  O28  1  0.78604600  0.08165800  0.76011900  1
  O  O29  1  0.81973100  0.33002200  0.15443000  1
  O  O30  1  0.31682100  0.07977700  0.90626000  1
  O  O31  1  0.08930000  0.26275200  0.55707600  1
  O  O32  1  0.41174200  0.48887200  0.18867900  1
  O  O33  1  0.91270700  0.23748100  0.94427600  1
  O  O34  1  0.68342500  0.41852500  0.59375700  1
  O  O35  1  0.21377200  0.41825100  0.74014400  1
  O  O36  1  0.78909900  0.57487400  0.26016100  1
  O  O37  1  0.32168100  0.58007000  0.40618300  1
  O  O38  1  0.08837600  0.76206700  0.06178400  1
  O  O39  1  0.58759600  0.50946200  0.81313900  1
  O  O40  1  0.91257200  0.73939800  0.43770300  1
  O  O41  1  0.68107000  0.91927000  0.09653600  1
  O  O42  1  0.17784100  0.66754700  0.84426300  1
  O  O43  1  0.20264500  0.92705100  0.23930200  1
  O  O44  1  0.71168900  0.67538300  0.99021100  1
  O  O45  1  0.28769300  0.82931400  0.51009100  1
  O  O46  1  0.82149300  0.83159100  0.65604600  1
  O  O47  1  0.41211400  0.98980800  0.68745000  1
