# generated using pymatgen
data_Li3V2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55657433
_cell_length_b   6.55657433
_cell_length_c   5.94068895
_cell_angle_alpha   76.34226119
_cell_angle_beta   76.34226119
_cell_angle_gamma   26.30503681
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3V2NiO6
_chemical_formula_sum   'Li3 V2 Ni1 O6'
_cell_volume   109.79512076
_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  0.00000000  0.00000000  1
  Li  Li1  1  0.66241500  0.66241500  0.66005100  1
  Li  Li2  1  0.33758500  0.33758500  0.33994900  1
  V  V3  1  0.66492500  0.66492500  0.16838400  1
  V  V4  1  0.33507500  0.33507500  0.83161600  1
  Ni  Ni5  1  0.00000000  0.00000000  0.50000000  1
  O  O6  1  0.16834000  0.16834000  0.39468700  1
  O  O7  1  0.82774900  0.82774900  0.07051300  1
  O  O8  1  0.83166000  0.83166000  0.60531300  1
  O  O9  1  0.48957700  0.48957700  0.75088000  1
  O  O10  1  0.51042300  0.51042300  0.24912000  1
  O  O11  1  0.17225100  0.17225100  0.92948700  1
