# generated using pymatgen
data_Li4Fe5NiO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11791100
_cell_length_b   5.11791100
_cell_length_c   10.32717334
_cell_angle_alpha   89.99249675
_cell_angle_beta   89.99249675
_cell_angle_gamma   118.72904127
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Fe5NiO12
_chemical_formula_sum   'Li4 Fe5 Ni1 O12'
_cell_volume   237.20196854
_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  0.34788400  0.85179800  0.75124400  1
  Li  Li1  1  0.14820200  0.65211600  0.24875600  1
  Li  Li2  1  0.85179800  0.34788400  0.75124400  1
  Li  Li3  1  0.65211600  0.14820200  0.24875600  1
  Fe  Fe4  1  0.16588400  0.83411600  0.50000000  1
  Fe  Fe5  1  0.66615300  0.33384700  0.00000000  1
  Fe  Fe6  1  0.33384700  0.66615300  0.00000000  1
  Fe  Fe7  1  0.83411600  0.16588400  0.50000000  1
  Fe  Fe8  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni9  1  0.00000000  0.00000000  0.00000000  1
  O  O10  1  0.33585700  0.96915700  0.10818300  1
  O  O11  1  0.03084300  0.66414300  0.89181700  1
  O  O12  1  0.47872600  0.83053500  0.39154300  1
  O  O13  1  0.83053500  0.47872600  0.39154300  1
  O  O14  1  0.16946500  0.52127400  0.60845700  1
  O  O15  1  0.83949000  0.83949000  0.59625800  1
  O  O16  1  0.52127400  0.16946500  0.60845700  1
  O  O17  1  0.96915700  0.33585700  0.10818300  1
  O  O18  1  0.64812400  0.64812400  0.09449900  1
  O  O19  1  0.66414300  0.03084300  0.89181700  1
  O  O20  1  0.35187600  0.35187600  0.90550100  1
  O  O21  1  0.16051000  0.16051000  0.40374200  1
