# generated using pymatgen
data_Li2V5NiO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78118615
_cell_length_b   6.78118547
_cell_length_c   5.77491611
_cell_angle_alpha   74.70594471
_cell_angle_beta   105.29404364
_cell_angle_gamma   97.30346658
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2V5NiO12
_chemical_formula_sum   'Li2 V5 Ni1 O12'
_cell_volume   246.60705014
_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  0.24448000  0.24448000  0.25000000  1
  Li  Li1  1  0.74462600  0.74462600  0.75000000  1
  V  V2  1  0.08355900  0.08355900  0.75000000  1
  V  V3  1  0.20200000  0.60807100  0.76786800  1
  V  V4  1  0.39236800  0.80172600  0.26253000  1
  V  V5  1  0.60807100  0.20200000  0.73213200  1
  V  V6  1  0.80172600  0.39236800  0.23747000  1
  Ni  Ni7  1  0.90846300  0.90846300  0.25000000  1
  O  O8  1  0.02087800  0.79738700  0.66002700  1
  O  O9  1  0.09841000  0.35738500  0.80939500  1
  O  O10  1  0.20163000  0.98179600  0.13573500  1
  O  O11  1  0.37577400  0.65896000  0.56793600  1
  O  O12  1  0.35738500  0.09841000  0.69060500  1
  O  O13  1  0.35331000  0.62448700  0.06746700  1
  O  O14  1  0.65896000  0.37577400  0.93206400  1
  O  O15  1  0.63593400  0.90875500  0.30754100  1
  O  O16  1  0.62448700  0.35331000  0.43253300  1
  O  O17  1  0.79738700  0.02087800  0.83997300  1
  O  O18  1  0.90875500  0.63593400  0.19245900  1
  O  O19  1  0.98179600  0.20163000  0.36426500  1
