# generated using pymatgen
data_Fe(NiO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88511793
_cell_length_b   5.93228560
_cell_length_c   5.93230090
_cell_angle_alpha   120.52485556
_cell_angle_beta   90.00138861
_cell_angle_gamma   119.73664729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe(NiO2)2
_chemical_formula_sum   'Fe2 Ni4 O8'
_cell_volume   145.85919301
_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
  Fe  Fe0  1  0.37120900  0.24242100  0.12878300  1.0
  Fe  Fe1  1  0.62879300  0.75757800  0.87121600  1.0
  Ni  Ni2  1  0.00000400  0.50000800  0.00000400  1.0
  Ni  Ni3  1  0.00000000  0.00000100  0.49999900  1.0
  Ni  Ni4  1  0.49999700  0.99999500  0.50000000  1.0
  Ni  Ni5  1  0.00000000  0.49999500  0.49999600  1.0
  O  O6  1  0.76023300  0.02046500  0.26882300  1.0
  O  O7  1  0.23976600  0.50858900  0.26023800  1.0
  O  O8  1  0.23976600  0.97953600  0.73117800  1.0
  O  O9  1  0.76883100  0.50858400  0.26024000  1.0
  O  O10  1  0.24129300  0.98258700  0.25870400  1.0
  O  O11  1  0.76023400  0.49141100  0.73976300  1.0
  O  O12  1  0.75870600  0.01741300  0.74129500  1.0
  O  O13  1  0.23116900  0.49141800  0.73976100  1.0