# generated using pymatgen
data_Li6Sn2B4SO16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56676725
_cell_length_b   9.56676725
_cell_length_c   9.56676725
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Sn2B4SO16
_chemical_formula_sum   'Li12 Sn4 B8 S2 O32'
_cell_volume   619.12825927
_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  0.21659900  0.21659900  0.78340100  1
  Li  Li1  1  0.78340100  0.21659900  0.21659900  1
  Li  Li2  1  0.78340100  0.21659900  0.78340100  1
  Li  Li3  1  0.21659900  0.78340100  0.21659900  1
  Li  Li4  1  0.46659900  0.46659900  0.03340100  1
  Li  Li5  1  0.03340100  0.46659900  0.46659900  1
  Li  Li6  1  0.21659900  0.78340100  0.78340100  1
  Li  Li7  1  0.78340100  0.78340100  0.21659900  1
  Li  Li8  1  0.03340100  0.46659900  0.03340100  1
  Li  Li9  1  0.46659900  0.03340100  0.46659900  1
  Li  Li10  1  0.03340100  0.03340100  0.46659900  1
  Li  Li11  1  0.46659900  0.03340100  0.03340100  1
  Sn  Sn12  1  0.62500000  0.12500000  0.62500000  1
  Sn  Sn13  1  0.62500000  0.62500000  0.12500000  1
  Sn  Sn14  1  0.12500000  0.62500000  0.62500000  1
  Sn  Sn15  1  0.62500000  0.62500000  0.62500000  1
  B  B16  1  0.40312300  0.40312300  0.40312300  1
  B  B17  1  0.79063000  0.40312300  0.40312300  1
  B  B18  1  0.40312300  0.40312300  0.79063000  1
  B  B19  1  0.40312300  0.79063000  0.40312300  1
  B  B20  1  0.84687700  0.45937000  0.84687700  1
  B  B21  1  0.84687700  0.84687700  0.45937000  1
  B  B22  1  0.45937000  0.84687700  0.84687700  1
  B  B23  1  0.84687700  0.84687700  0.84687700  1
  S  S24  1  0.25000000  0.25000000  0.25000000  1
  S  S25  1  0.00000000  0.00000000  0.00000000  1
  O  O26  1  0.18604000  0.18604000  0.18604000  1
  O  O27  1  0.18604000  0.18604000  0.44188000  1
  O  O28  1  0.44188000  0.18604000  0.18604000  1
  O  O29  1  0.18604000  0.44188000  0.18604000  1
  O  O30  1  0.41273100  0.25404400  0.54288800  1
  O  O31  1  0.54288800  0.41273100  0.25404400  1
  O  O32  1  0.79033800  0.25404400  0.41273100  1
  O  O33  1  0.25404400  0.54288800  0.41273100  1
  O  O34  1  0.54288800  0.25404400  0.79033800  1
  O  O35  1  0.25404400  0.41273100  0.79033800  1
  O  O36  1  0.79033800  0.54288800  0.25404400  1
  O  O37  1  0.79033800  0.41273100  0.54288800  1
  O  O38  1  0.41273100  0.79033800  0.25404400  1
  O  O39  1  0.41273100  0.54288800  0.79033800  1
  O  O40  1  0.25404400  0.79033800  0.54288800  1
  O  O41  1  0.70711200  0.45966200  0.83726900  1
  O  O42  1  0.54288800  0.79033800  0.41273100  1
  O  O43  1  0.99595600  0.45966200  0.70711200  1
  O  O44  1  0.83726900  0.70711200  0.45966200  1
  O  O45  1  0.83726900  0.45966200  0.99595600  1
  O  O46  1  0.45966200  0.83726900  0.70711200  1
  O  O47  1  0.45966200  0.70711200  0.99595600  1
  O  O48  1  0.99595600  0.83726900  0.45966200  1
  O  O49  1  0.70711200  0.99595600  0.45966200  1
  O  O50  1  0.99595600  0.70711200  0.83726900  1
  O  O51  1  0.45966200  0.99595600  0.83726900  1
  O  O52  1  0.70711200  0.83726900  0.99595600  1
  O  O53  1  0.83726900  0.99595600  0.70711200  1
  O  O54  1  0.06396000  0.80812000  0.06396000  1
  O  O55  1  0.06396000  0.06396000  0.80812000  1
  O  O56  1  0.80812000  0.06396000  0.06396000  1
  O  O57  1  0.06396000  0.06396000  0.06396000  1
