# generated using pymatgen
data_Li8Mn5Fe3(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24558400
_cell_length_b   6.04953980
_cell_length_c   16.18721499
_cell_angle_alpha   82.08500739
_cell_angle_beta   89.01367490
_cell_angle_gamma   89.01177461
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn5Fe3(BO3)8
_chemical_formula_sum   'Li8 Mn5 Fe3 B8 O24'
_cell_volume   508.64854325
_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  0.84992200  0.06299700  0.38936800  1
  Li  Li1  1  0.15065700  0.43560400  0.10938300  1
  Li  Li2  1  0.64995500  0.18756100  0.85946900  1
  Li  Li3  1  0.34928700  0.31147700  0.64078600  1
  Li  Li4  1  0.65064400  0.68768500  0.35841300  1
  Li  Li5  1  0.34923600  0.81244800  0.14128300  1
  Li  Li6  1  0.84941300  0.56430500  0.89102600  1
  Li  Li7  1  0.15230800  0.93636800  0.61007700  1
  Mn  Mn8  1  0.66754400  0.27347000  0.04097400  1
  Mn  Mn9  1  0.16663700  0.52114900  0.29102800  1
  Mn  Mn10  1  0.83435800  0.47681100  0.71051000  1
  Mn  Mn11  1  0.66596300  0.77508300  0.53910000  1
  Mn  Mn12  1  0.33221200  0.72686200  0.95914000  1
  Fe  Fe13  1  0.16025300  0.02525800  0.79055700  1
  Fe  Fe14  1  0.33126200  0.22460800  0.46209700  1
  Fe  Fe15  1  0.84087100  0.97386500  0.20925100  1
  B  B16  1  0.33113500  0.03728900  0.29771900  1
  B  B17  1  0.82738900  0.28587500  0.54652400  1
  B  B18  1  0.67086400  0.46285800  0.20257200  1
  B  B19  1  0.16924300  0.21477700  0.95090500  1
  B  B20  1  0.83043600  0.78537500  0.04907800  1
  B  B21  1  0.32933700  0.53698900  0.79729600  1
  B  B22  1  0.17056300  0.71480400  0.45221600  1
  B  B23  1  0.67022000  0.96340000  0.70310100  1
  O  O24  1  0.59044100  0.01278700  0.30845200  1
  O  O25  1  0.18595500  0.16898800  0.34633000  1
  O  O26  1  0.70634500  0.17034800  0.48975500  1
  O  O27  1  0.28761000  0.33059400  0.00764700  1
  O  O28  1  0.79338000  0.07799400  0.75999200  1
  O  O29  1  0.82064600  0.32701000  0.15671500  1
  O  O30  1  0.31761300  0.08112200  0.90348900  1
  O  O31  1  0.08771600  0.26346500  0.55816300  1
  O  O32  1  0.41159300  0.48565500  0.18875500  1
  O  O33  1  0.90992700  0.23603800  0.93849800  1
  O  O34  1  0.68163000  0.41838100  0.59461600  1
  O  O35  1  0.21455100  0.41805500  0.74081000  1
  O  O36  1  0.78737000  0.58150700  0.25877000  1
  O  O37  1  0.32068000  0.57900400  0.40667300  1
  O  O38  1  0.09000600  0.76442700  0.06148500  1
  O  O39  1  0.58835800  0.51478900  0.81159100  1
  O  O40  1  0.91127100  0.73636700  0.43818400  1
  O  O41  1  0.68163800  0.91885800  0.09649000  1
  O  O42  1  0.17872600  0.67263500  0.84294000  1
  O  O43  1  0.20684600  0.92430300  0.24072100  1
  O  O44  1  0.71232400  0.66973700  0.99215400  1
  O  O45  1  0.28559500  0.83301000  0.50904500  1
  O  O46  1  0.81844900  0.83118100  0.65525300  1
  O  O47  1  0.41161900  0.98683200  0.69159800  1
