# generated using pymatgen
data_Li3VBO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74924500
_cell_length_b   4.90922200
_cell_length_c   16.25552600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3VBO5
_chemical_formula_sum   'Li12 V4 B4 O20'
_cell_volume   378.99918234
_cell_formula_units_Z   4
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  0.01145000  0.70317400  0.61408700  1
  Li  Li1  1  0.01145000  0.20317400  0.88591300  1
  Li  Li2  1  0.50895700  0.32255900  0.00657800  1
  Li  Li3  1  0.50895700  0.82255900  0.49342200  1
  Li  Li4  1  0.49781900  0.34979000  0.79064900  1
  Li  Li5  1  0.49781900  0.84979000  0.70935100  1
  Li  Li6  1  0.51145000  0.29682600  0.38591300  1
  Li  Li7  1  0.51145000  0.79682600  0.11408700  1
  Li  Li8  1  0.00895700  0.67744100  0.99342200  1
  Li  Li9  1  0.00895700  0.17744100  0.50657800  1
  Li  Li10  1  0.99781900  0.15021000  0.29064900  1
  Li  Li11  1  0.99781900  0.65021000  0.20935100  1
  V  V12  1  0.01466600  0.16379400  0.10183700  1
  V  V13  1  0.01466600  0.66379400  0.39816300  1
  V  V14  1  0.51466600  0.33620600  0.60183700  1
  V  V15  1  0.51466600  0.83620600  0.89816300  1
  B  B16  1  0.99533600  0.19011300  0.70763600  1
  B  B17  1  0.99533600  0.69011300  0.79236400  1
  B  B18  1  0.49533600  0.30988700  0.20763600  1
  B  B19  1  0.49533600  0.80988700  0.29236400  1
  O  O20  1  0.08998500  0.39317700  0.77414600  1
  O  O21  1  0.08998500  0.89317700  0.72585400  1
  O  O22  1  0.07984200  0.31599500  0.39333700  1
  O  O23  1  0.07984200  0.81599500  0.10666300  1
  O  O24  1  0.08743000  0.29847800  0.00395000  1
  O  O25  1  0.08743000  0.79847800  0.49605000  1
  O  O26  1  0.18682000  0.30852300  0.19840200  1
  O  O27  1  0.18682000  0.80852300  0.30159800  1
  O  O28  1  0.12269300  0.27679400  0.62690500  1
  O  O29  1  0.12269300  0.77679400  0.87309500  1
  O  O30  1  0.58998500  0.60682300  0.22585400  1
  O  O31  1  0.58998500  0.10682300  0.27414600  1
  O  O32  1  0.57984200  0.68400500  0.60666300  1
  O  O33  1  0.57984200  0.18400500  0.89333700  1
  O  O34  1  0.58743000  0.20152200  0.50395000  1
  O  O35  1  0.58743000  0.70152200  0.99605000  1
  O  O36  1  0.68682000  0.19147700  0.69840200  1
  O  O37  1  0.68682000  0.69147700  0.80159800  1
  O  O38  1  0.62269300  0.22320600  0.12690500  1
  O  O39  1  0.62269300  0.72320600  0.37309500  1
