# generated using pymatgen
data_Li6V2B4SO16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.46056264
_cell_length_b   9.46056264
_cell_length_c   9.46056264
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6V2B4SO16
_chemical_formula_sum   'Li12 V4 B8 S2 O32'
_cell_volume   598.73672794
_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  0.97048400  0.97048400  0.52951600  1
  Li  Li1  1  0.72048400  0.27951600  0.27951600  1
  Li  Li2  1  0.97048400  0.52951600  0.97048400  1
  Li  Li3  1  0.52951600  0.97048400  0.52951600  1
  Li  Li4  1  0.72048400  0.72048400  0.27951600  1
  Li  Li5  1  0.27951600  0.72048400  0.72048400  1
  Li  Li6  1  0.52951600  0.52951600  0.97048400  1
  Li  Li7  1  0.97048400  0.52951600  0.52951600  1
  Li  Li8  1  0.27951600  0.72048400  0.27951600  1
  Li  Li9  1  0.72048400  0.27951600  0.72048400  1
  Li  Li10  1  0.52951600  0.97048400  0.97048400  1
  Li  Li11  1  0.27951600  0.27951600  0.72048400  1
  V  V12  1  0.12500000  0.62500000  0.12500000  1
  V  V13  1  0.12500000  0.12500000  0.62500000  1
  V  V14  1  0.12500000  0.12500000  0.12500000  1
  V  V15  1  0.62500000  0.12500000  0.12500000  1
  B  B16  1  0.34253600  0.97239100  0.34253600  1
  B  B17  1  0.97239100  0.34253600  0.34253600  1
  B  B18  1  0.34253600  0.34253600  0.97239100  1
  B  B19  1  0.34253600  0.34253600  0.34253600  1
  B  B20  1  0.90746400  0.90746400  0.90746400  1
  B  B21  1  0.27760900  0.90746400  0.90746400  1
  B  B22  1  0.90746400  0.90746400  0.27760900  1
  B  B23  1  0.90746400  0.27760900  0.90746400  1
  S  S24  1  0.75000000  0.75000000  0.75000000  1
  S  S25  1  0.50000000  0.50000000  0.50000000  1
  O  O26  1  0.92660600  0.04199100  0.27905000  1
  O  O27  1  0.75235300  0.27905000  0.04199100  1
  O  O28  1  0.20800900  0.97095000  0.32339400  1
  O  O29  1  0.32339400  0.97095000  0.49764700  1
  O  O30  1  0.68538000  0.68538000  0.68538000  1
  O  O31  1  0.97095000  0.32339400  0.20800900  1
  O  O32  1  0.97095000  0.20800900  0.49764700  1
  O  O33  1  0.94386100  0.68538000  0.68538000  1
  O  O34  1  0.68538000  0.68538000  0.94386100  1
  O  O35  1  0.49764700  0.32339400  0.97095000  1
  O  O36  1  0.20800900  0.49764700  0.97095000  1
  O  O37  1  0.68538000  0.94386100  0.68538000  1
  O  O38  1  0.49764700  0.20800900  0.32339400  1
  O  O39  1  0.97095000  0.49764700  0.32339400  1
  O  O40  1  0.20800900  0.32339400  0.49764700  1
  O  O41  1  0.92660600  0.75235300  0.04199100  1
  O  O42  1  0.32339400  0.49764700  0.20800900  1
  O  O43  1  0.04199100  0.92660600  0.75235300  1
  O  O44  1  0.27905000  0.75235300  0.92660600  1
  O  O45  1  0.75235300  0.04199100  0.92660600  1
  O  O46  1  0.56462000  0.30613900  0.56462000  1
  O  O47  1  0.04199100  0.75235300  0.27905000  1
  O  O48  1  0.75235300  0.92660600  0.27905000  1
  O  O49  1  0.30613900  0.56462000  0.56462000  1
  O  O50  1  0.56462000  0.56462000  0.30613900  1
  O  O51  1  0.27905000  0.04199100  0.75235300  1
  O  O52  1  0.27905000  0.92660600  0.04199100  1
  O  O53  1  0.56462000  0.56462000  0.56462000  1
  O  O54  1  0.92660600  0.27905000  0.75235300  1
  O  O55  1  0.04199100  0.27905000  0.92660600  1
  O  O56  1  0.49764700  0.97095000  0.20800900  1
  O  O57  1  0.32339400  0.20800900  0.97095000  1
