# generated using pymatgen
data_Li6Fe5NiO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03586778
_cell_length_b   5.03586778
_cell_length_c   10.00151600
_cell_angle_alpha   85.75539749
_cell_angle_beta   85.75539749
_cell_angle_gamma   120.16333606
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Fe5NiO12
_chemical_formula_sum   'Li6 Fe5 Ni1 O12'
_cell_volume   216.86659390
_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  0.11245700  0.11384500  0.74614200  1
  Li  Li1  1  0.56178100  0.23140000  0.25816900  1
  Li  Li2  1  0.22600400  0.55669900  0.26092400  1
  Li  Li3  1  0.76860000  0.43821900  0.74183100  1
  Li  Li4  1  0.44330100  0.77399600  0.73907600  1
  Li  Li5  1  0.88615500  0.88754300  0.25385800  1
  Fe  Fe6  1  0.49958100  0.50041900  0.50000000  1
  Fe  Fe7  1  0.83388700  0.16611300  0.50000000  1
  Fe  Fe8  1  0.16600300  0.83399700  0.50000000  1
  Fe  Fe9  1  0.66731500  0.33268500  0.00000000  1
  Fe  Fe10  1  0.33263300  0.66736700  0.00000000  1
  Ni  Ni11  1  0.99937900  0.00062100  0.00000000  1
  O  O12  1  0.21617300  0.21648400  0.38420700  1
  O  O13  1  0.70958500  0.05594600  0.88845200  1
  O  O14  1  0.01647300  0.68901700  0.89084500  1
  O  O15  1  0.46743300  0.15048900  0.61613000  1
  O  O16  1  0.15247000  0.46879700  0.61676800  1
  O  O17  1  0.38266600  0.36296900  0.89143700  1
  O  O18  1  0.63703100  0.61733400  0.10856300  1
  O  O19  1  0.84951100  0.53256700  0.38387000  1
  O  O20  1  0.53120300  0.84753000  0.38323200  1
  O  O21  1  0.94405400  0.29041500  0.11154800  1
  O  O22  1  0.31098300  0.98352700  0.10915500  1
  O  O23  1  0.78351600  0.78382700  0.61579300  1
