data_[Li4Fe3Ni2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Fe  1.8300  1.4000  0.8525
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.0986]
_cell_length_b [5.1003]
_cell_length_c [7.7481]
_cell_angle_alpha [71.2548]
_cell_angle_beta [71.2459]
_cell_angle_gamma [79.8244]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li4Fe3(NiO5)2]
_chemical_formula_sum '[Li4 Fe3 Ni2 O10]'
_cell_volume [180.0613]
_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  0.4867  0.3817  0.2255  1.0
  Li  Li1  1  0.4872  0.7750  0.4287  1.0
  Li  Li2  1  0.5107  0.2032  0.5892  1.0
  Li  Li3  1  0.9803  0.4964  0.5087  1.0
  Fe  Fe4  1  0.5001  0.0001  0.9935  1.0
  Fe  Fe5  1  0.9976  0.6933  0.1140  1.0
  Fe  Fe6  1  0.9978  0.3195  0.8855  1.0
  Ni  Ni7  1  0.0005  0.1019  0.3058  1.0
  Ni  Ni8  1  0.0077  0.9001  0.6924  1.0
  O  O9  1  0.2114  0.5681  0.6583  1.0
  O  O10  1  0.2231  0.3233  0.0709  1.0
  O  O11  1  0.2281  0.1209  0.4663  1.0
  O  O12  1  0.2364  0.9678  0.8543  1.0
  O  O13  1  0.2581  0.7650  0.2289  1.0
  O  O14  1  0.7549  0.0538  0.1374  1.0
  O  O15  1  0.7628  0.4520  0.3385  1.0
  O  O16  1  0.7685  0.2105  0.7551  1.0
  O  O17  1  0.7866  0.6751  0.9357  1.0
  O  O18  1  0.7948  0.8833  0.5321  1.0
]