# generated using pymatgen
data_Li4Nb3V3(NiO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07571678
_cell_length_b   6.07571678
_cell_length_c   9.88159432
_cell_angle_alpha   89.65999919
_cell_angle_beta   89.65999919
_cell_angle_gamma   60.14412931
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Nb3V3(NiO8)2
_chemical_formula_sum   'Li4 Nb3 V3 Ni2 O16'
_cell_volume   316.35259187
_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  0.66607200  0.66607200  0.90027300  1
  Li  Li1  1  0.00599500  0.00599500  0.00344600  1
  Li  Li2  1  0.01210200  0.01210200  0.49208000  1
  Li  Li3  1  0.33261000  0.33261000  0.38251000  1
  Nb  Nb4  1  0.82889900  0.82889900  0.21875800  1
  Nb  Nb5  1  0.66046200  0.16398800  0.71498500  1
  Nb  Nb6  1  0.16398800  0.66046200  0.71498500  1
  V  V7  1  0.82692400  0.33943900  0.21214300  1
  V  V8  1  0.33943900  0.82692400  0.21214300  1
  V  V9  1  0.16807100  0.16807100  0.71194100  1
  Ni  Ni10  1  0.65971000  0.65971000  0.48058900  1
  Ni  Ni11  1  0.32728400  0.32728400  0.00775300  1
  O  O12  1  0.83971800  0.31690600  0.60699300  1
  O  O13  1  0.51747400  0.51747400  0.33143200  1
  O  O14  1  0.67352500  0.67352500  0.09839800  1
  O  O15  1  0.99780000  0.99780000  0.31378900  1
  O  O16  1  0.99707500  0.99707500  0.81762600  1
  O  O17  1  0.31690600  0.83971800  0.60699300  1
  O  O18  1  0.96466900  0.51811200  0.33647600  1
  O  O19  1  0.51811200  0.96466900  0.33647600  1
  O  O20  1  0.15850300  0.15850300  0.10951500  1
  O  O21  1  0.84035900  0.84035900  0.60062000  1
  O  O22  1  0.48679400  0.03291800  0.83155800  1
  O  O23  1  0.03291800  0.48679400  0.83155800  1
  O  O24  1  0.33898600  0.33898600  0.59744600  1
  O  O25  1  0.67705100  0.15833300  0.10330600  1
  O  O26  1  0.48392900  0.48392900  0.82997400  1
  O  O27  1  0.15833300  0.67705100  0.10330600  1
