# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23596800
_cell_length_b   5.24888994
_cell_length_c   20.94930555
_cell_angle_alpha   90.70817569
_cell_angle_beta   90.92956776
_cell_angle_gamma   119.89517390
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   498.93559454
_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  0.67841200  0.65077900  0.33339000  1
  Li  Li1  1  0.65258000  0.67756700  0.08380600  1
  Li  Li2  1  0.67721400  0.65204200  0.83432400  1
  Li  Li3  1  0.65151000  0.67895900  0.58411700  1
  Li  Li4  1  0.35111200  0.33773500  0.20808400  1
  Li  Li5  1  0.33762200  0.34804300  0.45867500  1
  Li  Li6  1  0.34649900  0.33717700  0.70843800  1
  Li  Li7  1  0.33700400  0.34625000  0.95867800  1
  Mn  Mn8  1  0.67069500  0.00297100  0.44141700  1
  Mn  Mn9  1  0.67186800  0.00655800  0.94192900  1
  Mn  Mn10  1  0.32272400  0.00292100  0.56675300  1
  Mn  Mn11  1  0.00278400  0.32552000  0.31594400  1
  Mn  Mn12  1  0.00305700  0.66817300  0.69266700  1
  Fe  Fe13  1  0.31558100  0.99803300  0.06721800  1
  Fe  Fe14  1  0.00584900  0.31927800  0.81652600  1
  Fe  Fe15  1  0.00272700  0.66745800  0.19086800  1
  B  B16  1  0.99668600  0.33758200  0.06364100  1
  B  B17  1  0.99780500  0.34152600  0.56301600  1
  B  B18  1  0.66746100  0.00819700  0.18689900  1
  B  B19  1  0.66615800  0.00421400  0.68867900  1
  B  B20  1  0.34002700  0.99631900  0.31185300  1
  B  B21  1  0.33905700  0.99674600  0.81330300  1
  B  B22  1  0.00401600  0.66589800  0.43784300  1
  B  B23  1  0.00513000  0.66745000  0.93790500  1
  O  O24  1  0.93165100  0.25771800  0.20676000  1
  O  O25  1  0.92942300  0.24593700  0.70963800  1
  O  O26  1  0.74133400  0.07257400  0.04944300  1
  O  O27  1  0.97867000  0.58442500  0.08258200  1
  O  O28  1  0.74672000  0.07050200  0.54789800  1
  O  O29  1  0.96682000  0.57870800  0.58385100  1
  O  O30  1  0.41820900  0.03117800  0.17285200  1
  O  O31  1  0.73081300  0.64143600  0.43042400  1
  O  O32  1  0.42187700  0.03641500  0.67336900  1
  O  O33  1  0.73084900  0.64321000  0.93077800  1
  O  O34  1  0.65562400  0.73988700  0.18077300  1
  O  O35  1  0.64209500  0.73026600  0.68103500  1
  O  O36  1  0.36879700  0.27187400  0.30503700  1
  O  O37  1  0.35923800  0.27019400  0.80650600  1
  O  O38  1  0.27057400  0.35818600  0.05707200  1
  O  O39  1  0.57821700  0.96708600  0.33283400  1
  O  O40  1  0.27266600  0.37108700  0.55575100  1
  O  O41  1  0.58507100  0.97819200  0.83212500  1
  O  O42  1  0.03769900  0.42290100  0.42239500  1
  O  O43  1  0.03753200  0.42382200  0.92237300  1
  O  O44  1  0.24713600  0.92983700  0.45905600  1
  O  O45  1  0.24747500  0.92993600  0.95927200  1
  O  O46  1  0.06889700  0.74661200  0.29663700  1
  O  O47  1  0.07023300  0.74182200  0.79937200  1
