# generated using pymatgen
data_Li2Fe(NiO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56825500
_cell_length_b   6.63868830
_cell_length_c   8.32147125
_cell_angle_alpha   70.60628698
_cell_angle_beta   70.36165789
_cell_angle_gamma   82.33236638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe(NiO3)2
_chemical_formula_sum   'Li6 Fe3 Ni6 O18'
_cell_volume   322.25975172
_cell_formula_units_Z   3
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  0.83490900  0.49035600  0.67249500  1
  Li  Li1  1  0.16509100  0.50964400  0.32750500  1
  Li  Li2  1  0.50460600  0.15113400  0.33545800  1
  Li  Li3  1  0.82756200  0.16248700  0.00151800  1
  Li  Li4  1  0.49539400  0.84886600  0.66454200  1
  Li  Li5  1  0.17243800  0.83751300  0.99848200  1
  Fe  Fe6  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe7  1  0.83187100  0.50593900  0.15963400  1
  Fe  Fe8  1  0.16812900  0.49406100  0.84036600  1
  Ni  Ni9  1  0.83137900  0.83783000  0.82732600  1
  Ni  Ni10  1  0.83645700  0.16615600  0.49806100  1
  Ni  Ni11  1  0.16862100  0.16217000  0.17267400  1
  Ni  Ni12  1  0.50261200  0.16645800  0.83254000  1
  Ni  Ni13  1  0.16354300  0.83384400  0.50193900  1
  Ni  Ni14  1  0.49738800  0.83354200  0.16746000  1
  O  O15  1  0.14876500  0.81892000  0.73939100  1
  O  O16  1  0.46387500  0.82213900  0.43344900  1
  O  O17  1  0.81394600  0.83127700  0.06114900  1
  O  O18  1  0.49047300  0.47613300  0.74291900  1
  O  O19  1  0.82998700  0.46606200  0.41922100  1
  O  O20  1  0.81085600  0.16566000  0.73243200  1
  O  O21  1  0.17001300  0.53393800  0.58077900  1
  O  O22  1  0.50952700  0.52386700  0.25708100  1
  O  O23  1  0.53612500  0.17786100  0.56655100  1
  O  O24  1  0.14799600  0.50514200  0.08226300  1
  O  O25  1  0.14729400  0.14138200  0.41189400  1
  O  O26  1  0.48292300  0.13250100  0.09848500  1
  O  O27  1  0.85200400  0.49485800  0.91773700  1
  O  O28  1  0.85123500  0.18108000  0.26060900  1
  O  O29  1  0.18605400  0.16872300  0.93885100  1
  O  O30  1  0.85270600  0.85861800  0.58810600  1
  O  O31  1  0.18914400  0.83434000  0.26756800  1
  O  O32  1  0.51707700  0.86749900  0.90151500  1
