# generated using pymatgen
data_Li12Fe5O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87027700
_cell_length_b   5.89256291
_cell_length_c   9.79066973
_cell_angle_alpha   92.47110465
_cell_angle_beta   90.54255442
_cell_angle_gamma   118.61776660
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li12Fe5O16
_chemical_formula_sum   'Li12 Fe5 O16'
_cell_volume   296.84350585
_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  0.66962500  0.91278800  0.22349900  1
  Li  Li1  1  0.58534200  0.78959700  0.96696100  1
  Li  Li2  1  0.98686100  0.01319800  0.02970200  1
  Li  Li3  1  0.22747200  0.91590400  0.22352100  1
  Li  Li4  1  0.90056600  0.80333700  0.45322700  1
  Li  Li5  1  0.15959100  0.77968900  0.95689000  1
  Li  Li6  1  0.32181100  0.65673400  0.72158000  1
  Li  Li7  1  0.18461100  0.38176800  0.94829700  1
  Li  Li8  1  0.71765800  0.43616800  0.23470300  1
  Li  Li9  1  0.81543800  0.65611500  0.71975500  1
  Li  Li10  1  0.87906300  0.26040500  0.44614100  1
  Li  Li11  1  0.37593800  0.26104000  0.44851200  1
  Fe  Fe12  1  0.32642600  0.16328800  0.71515700  1
  Fe  Fe13  1  0.38594100  0.76985000  0.45965700  1
  Fe  Fe14  1  0.65948700  0.34618300  0.97246600  1
  Fe  Fe15  1  0.19604800  0.40125100  0.21417300  1
  Fe  Fe16  1  0.83358600  0.16744700  0.71409200  1
  O  O17  1  0.66439900  0.85356400  0.59812500  1
  O  O18  1  0.52634000  0.06317800  0.35722200  1
  O  O19  1  0.19311500  0.84786200  0.58717800  1
  O  O20  1  0.31953900  0.67503700  0.10235800  1
  O  O21  1  0.52233000  0.59006600  0.35225500  1
  O  O22  1  0.06825100  0.57961300  0.34532700  1
  O  O23  1  0.81953300  0.66834100  0.06544800  1
  O  O24  1  0.15700500  0.32276100  0.60473400  1
  O  O25  1  0.97152900  0.46827100  0.83552800  1
  O  O26  1  0.82715500  0.21244500  0.08728000  1
  O  O27  1  0.04297400  0.10420100  0.31281600  1
  O  O28  1  0.65344900  0.30880900  0.61766200  1
  O  O29  1  0.00470300  0.01739900  0.82231000  1
  O  O30  1  0.49662300  0.47734600  0.84635700  1
  O  O31  1  0.33091300  0.22050900  0.09516000  1
  O  O32  1  0.49958200  0.02141500  0.85369400  1
