# generated using pymatgen
data_BaLiV2Ni3(HO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97146416
_cell_length_b   5.94968831
_cell_length_c   8.30411960
_cell_angle_alpha   59.34239170
_cell_angle_beta   68.75244276
_cell_angle_gamma   59.86570072
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLiV2Ni3(HO5)2
_chemical_formula_sum   'Ba1 Li1 V2 Ni3 H2 O10'
_cell_volume   217.23810413
_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
  Ba  Ba0  1  0.11290200  0.29903700  0.47665600  1
  Li  Li1  1  0.82228300  0.68004800  0.69225200  1
  V  V2  1  0.53716100  0.18129900  0.74524300  1
  V  V3  1  0.45332100  0.83355900  0.25510700  1
  Ni  Ni4  1  0.99190800  0.02191100  0.99433600  1
  Ni  Ni5  1  0.99037200  0.50370100  0.01291600  1
  Ni  Ni6  1  0.49502100  0.50457200  0.01024300  1
  H  H7  1  0.25804100  0.74485900  0.73710500  1
  H  H8  1  0.76514200  0.17463700  0.29226700  1
  O  O9  1  0.17008400  0.31767200  0.80570400  1
  O  O10  1  0.70825200  0.31850400  0.80375600  1
  O  O11  1  0.79940700  0.71041100  0.20196000  1
  O  O12  1  0.28564700  0.71233500  0.19853500  1
  O  O13  1  0.65964600  0.79255500  0.89179700  1
  O  O14  1  0.31858400  0.20911700  0.15349500  1
  O  O15  1  0.36696400  0.75847300  0.49338700  1
  O  O16  1  0.66807400  0.13302700  0.53007300  1
  O  O17  1  0.19162100  0.75678900  0.86112800  1
  O  O18  1  0.80140400  0.24332800  0.15237400  1
