# generated using pymatgen
data_Li3Fe2(NiO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84270000
_cell_length_b   5.86698792
_cell_length_c   5.90658746
_cell_angle_alpha   119.28917184
_cell_angle_beta   119.56924872
_cell_angle_gamma   90.06625114
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2(NiO4)2
_chemical_formula_sum   'Li3 Fe2 Ni2 O8'
_cell_volume   145.52509788
_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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Fe  Fe3  1  0.50000000  0.00000000  0.00000000  1
  Fe  Fe4  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni5  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni6  1  0.50000000  0.00000000  0.50000000  1
  O  O7  1  0.71063800  0.21316200  0.45181000  1
  O  O8  1  0.26305100  0.76924600  0.98855100  1
  O  O9  1  0.25934900  0.22335100  0.47833000  1
  O  O10  1  0.72856400  0.77166600  0.99385400  1
  O  O11  1  0.27143600  0.22833400  0.00614600  1
  O  O12  1  0.74065100  0.77664900  0.52167000  1
  O  O13  1  0.73694900  0.23075400  0.01144900  1
  O  O14  1  0.28936200  0.78683800  0.54819000  1
