# generated using pymatgen
data_Li3Fe3(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.06708700
_cell_length_b   5.22159000
_cell_length_c   10.99174009
_cell_angle_alpha   64.53877478
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe3(BO3)4
_chemical_formula_sum   'Li6 Fe6 B8 O24'
_cell_volume   469.85658173
_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  0.21574400  0.50592000  0.33493600  1
  Li  Li1  1  0.22768800  0.86054000  0.91536300  1
  Li  Li2  1  0.72986400  0.10342700  0.59925500  1
  Li  Li3  1  0.78425600  0.50592000  0.83493600  1
  Li  Li4  1  0.77231200  0.86054000  0.41536300  1
  Li  Li5  1  0.27013600  0.10342700  0.09925500  1
  Fe  Fe6  1  0.57718600  0.97488500  0.86509500  1
  Fe  Fe7  1  0.72050200  0.46372000  0.18408700  1
  Fe  Fe8  1  0.04221100  0.03177800  0.61691900  1
  Fe  Fe9  1  0.42281400  0.97488500  0.36509500  1
  Fe  Fe10  1  0.95778900  0.03177800  0.11691900  1
  Fe  Fe11  1  0.27949800  0.46372000  0.68408700  1
  B  B12  1  0.55252700  0.44440700  0.38586100  1
  B  B13  1  0.90836100  0.98271800  0.86349300  1
  B  B14  1  0.05896800  0.56536200  0.11574400  1
  B  B15  1  0.40051200  0.01928200  0.63246600  1
  B  B16  1  0.09163900  0.98271800  0.36349300  1
  B  B17  1  0.44747300  0.44440700  0.88586100  1
  B  B18  1  0.59948800  0.01928200  0.13246600  1
  B  B19  1  0.94103200  0.56536200  0.61574400  1
  O  O20  1  0.60279400  0.79814100  0.09252300  1
  O  O21  1  0.89952000  0.33542000  0.59726300  1
  O  O22  1  0.15094200  0.78378200  0.10556400  1
  O  O23  1  0.91232100  0.61167400  0.14442200  1
  O  O24  1  0.52902000  0.11010000  0.66757300  1
  O  O25  1  0.26619500  0.14447300  0.64118500  1
  O  O26  1  0.41601600  0.34096400  0.37413000  1
  O  O27  1  0.03553100  0.91085600  0.81629800  1
  O  O28  1  0.67634300  0.29165900  0.37278400  1
  O  O29  1  0.77338100  0.86657200  0.84731300  1
  O  O30  1  0.09055800  0.16444100  0.42513200  1
  O  O31  1  0.42494900  0.68706200  0.90225500  1
  O  O32  1  0.10048000  0.33542000  0.09726300  1
  O  O33  1  0.39720600  0.79814100  0.59252300  1
  O  O34  1  0.47098000  0.11010000  0.16757300  1
  O  O35  1  0.84905800  0.78378200  0.60556400  1
  O  O36  1  0.73380500  0.14447300  0.14118500  1
  O  O37  1  0.08767900  0.61167400  0.64442200  1
  O  O38  1  0.96446900  0.91085600  0.31629800  1
  O  O39  1  0.58398400  0.34096400  0.87413000  1
  O  O40  1  0.22661900  0.86657200  0.34731300  1
  O  O41  1  0.32365700  0.29165900  0.87278400  1
  O  O42  1  0.57505100  0.68706200  0.40225500  1
  O  O43  1  0.90944200  0.16444100  0.92513200  1
