# generated using pymatgen
data_Li4Mn3Fe(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24963500
_cell_length_b   5.25489037
_cell_length_c   21.00431306
_cell_angle_alpha   91.16627264
_cell_angle_beta   90.60907148
_cell_angle_gamma   119.82121568
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Fe(BO3)4
_chemical_formula_sum   'Li8 Mn6 Fe2 B8 O24'
_cell_volume   502.45499350
_cell_formula_units_Z   2
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  0.34757900  0.32303700  0.66612200  1
  Li  Li1  1  0.32192300  0.34743600  0.91608000  1
  Li  Li2  1  0.34928300  0.32120700  0.16609300  1
  Li  Li3  1  0.32169700  0.34929100  0.41616500  1
  Li  Li4  1  0.66463400  0.65250700  0.79097800  1
  Li  Li5  1  0.65149000  0.66223700  0.54188500  1
  Li  Li6  1  0.66225000  0.65169800  0.29124300  1
  Li  Li7  1  0.65181200  0.66199000  0.04109900  1
  Mn  Mn8  1  0.99325500  0.32568000  0.55923000  1
  Mn  Mn9  1  0.99631200  0.32936400  0.05819000  1
  Mn  Mn10  1  0.99976500  0.67871900  0.93254400  1
  Mn  Mn11  1  0.99745500  0.67638800  0.43376000  1
  Mn  Mn12  1  0.67698100  0.99693100  0.18337600  1
  Mn  Mn13  1  0.32905900  0.99601700  0.30839500  1
  Fe  Fe14  1  0.67579600  0.99364500  0.68472400  1
  Fe  Fe15  1  0.33582300  0.00320700  0.80708300  1
  B  B16  1  0.65886400  0.00348900  0.93653400  1
  B  B17  1  0.65834100  0.00260400  0.43720700  1
  B  B18  1  0.99545800  0.33272200  0.81118100  1
  B  B19  1  0.99477300  0.33389100  0.31204000  1
  B  B20  1  0.00290300  0.66245500  0.68744700  1
  B  B21  1  0.00292700  0.65831400  0.18713200  1
  B  B22  1  0.33367900  0.99363300  0.56302800  1
  B  B23  1  0.33401000  0.99509000  0.06203800  1
  O  O24  1  0.74734500  0.06978900  0.79192300  1
  O  O25  1  0.75351100  0.07068300  0.29092800  1
  O  O26  1  0.92924100  0.25420800  0.95169700  1
  O  O27  1  0.42154800  0.03346000  0.91580100  1
  O  O28  1  0.92873600  0.25297600  0.45238900  1
  O  O29  1  0.42092900  0.03268100  0.41643500  1
  O  O30  1  0.97442900  0.58263000  0.82530300  1
  O  O31  1  0.35751200  0.26786700  0.56997700  1
  O  O32  1  0.96217600  0.57766800  0.32733400  1
  O  O33  1  0.35859300  0.26893000  0.06921600  1
  O  O34  1  0.26551300  0.34573100  0.81808600  1
  O  O35  1  0.26912500  0.35834200  0.31955800  1
  O  O36  1  0.72930800  0.64292100  0.69375200  1
  O  O37  1  0.72730400  0.62903900  0.19430000  1
  O  O38  1  0.62996700  0.72845700  0.94373600  1
  O  O39  1  0.01973900  0.41585800  0.66873100  1
  O  O40  1  0.62914000  0.72787800  0.44467500  1
  O  O41  1  0.03336400  0.42070100  0.16647900  1
  O  O42  1  0.57712800  0.96189900  0.57877400  1
  O  O43  1  0.57762900  0.96236700  0.07739600  1
  O  O44  1  0.07117500  0.75123200  0.54168000  1
  O  O45  1  0.07068000  0.75279000  0.04092700  1
  O  O46  1  0.25589600  0.93006500  0.70131300  1
  O  O47  1  0.25274400  0.92907200  0.20221400  1
