# generated using pymatgen
data_Li2VNiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88963945
_cell_length_b   5.89864885
_cell_length_c   5.89277632
_cell_angle_alpha   60.45182610
_cell_angle_beta   89.00692257
_cell_angle_gamma   119.19302263
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2VNiO4
_chemical_formula_sum   'Li4 V2 Ni2 O8'
_cell_volume   146.23638849
_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
  Li  Li0  1  0.00000000  0.00000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Li  Li3  1  0.50000000  0.00000000  0.50000000  1
  V  V4  1  0.00000000  0.99999900  0.00000000  1
  V  V5  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni6  1  0.00000000  0.50000200  0.00000000  1
  Ni  Ni7  1  0.50000000  0.00000100  0.00000000  1
  O  O8  1  0.22911200  0.99329500  0.77667700  1
  O  O9  1  0.22995000  0.50675400  0.26421700  1
  O  O10  1  0.77005000  0.49324500  0.73578300  1
  O  O11  1  0.77088700  0.00670500  0.22332300  1
  O  O12  1  0.23084900  0.98177800  0.25215000  1
  O  O13  1  0.76606800  0.51853100  0.25062000  1
  O  O14  1  0.23393200  0.48146900  0.74938000  1
  O  O15  1  0.76915100  0.01822100  0.74785000  1
