# generated using pymatgen
data_Li3V3(BO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.42226400
_cell_length_b   3.01177000
_cell_length_c   12.00100617
_cell_angle_alpha   89.85548813
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3V3(BO5)2
_chemical_formula_sum   'Li6 V6 B4 O20'
_cell_volume   340.55977417
_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  0.00000000  1
  Li  Li1  1  0.00672500  0.00167200  0.27722100  1
  Li  Li2  1  0.49327500  0.00167200  0.77722100  1
  Li  Li3  1  0.50000000  0.00000000  0.50000000  1
  Li  Li4  1  0.50672500  0.99832800  0.22277900  1
  Li  Li5  1  0.99327500  0.99832800  0.72277900  1
  V  V6  1  0.00000000  0.50000000  0.50000000  1
  V  V7  1  0.76601800  0.47550500  0.11457400  1
  V  V8  1  0.73398200  0.47550500  0.61457400  1
  V  V9  1  0.50000000  0.50000000  0.00000000  1
  V  V10  1  0.26601800  0.52449500  0.38542600  1
  V  V11  1  0.23398200  0.52449500  0.88542600  1
  B  B12  1  0.76436600  0.50430900  0.86176500  1
  B  B13  1  0.73563400  0.50430900  0.36176500  1
  B  B14  1  0.26436600  0.49569100  0.63823500  1
  B  B15  1  0.23563400  0.49569100  0.13823500  1
  O  O16  1  0.87774100  0.00611100  0.14576400  1
  O  O17  1  0.87871200  0.99307800  0.56901600  1
  O  O18  1  0.88320800  0.50423200  0.36282800  1
  O  O19  1  0.83515100  0.49774300  0.75987400  1
  O  O20  1  0.84410600  0.51153200  0.95918500  1
  O  O21  1  0.65589400  0.51153200  0.45918500  1
  O  O22  1  0.66484900  0.49774300  0.25987400  1
  O  O23  1  0.61679200  0.50423200  0.86282800  1
  O  O24  1  0.62128800  0.99307800  0.06901600  1
  O  O25  1  0.62225900  0.00611100  0.64576400  1
  O  O26  1  0.37774100  0.99388900  0.35423600  1
  O  O27  1  0.37871200  0.00692200  0.93098400  1
  O  O28  1  0.38320800  0.49576800  0.13717200  1
  O  O29  1  0.33515100  0.50225700  0.74012600  1
  O  O30  1  0.34410600  0.48846800  0.54081500  1
  O  O31  1  0.15589400  0.48846800  0.04081500  1
  O  O32  1  0.16484900  0.50225700  0.24012600  1
  O  O33  1  0.11679200  0.49576800  0.63717200  1
  O  O34  1  0.12128800  0.00692200  0.43098400  1
  O  O35  1  0.12225900  0.99388900  0.85423600  1
