# generated using pymatgen
data_Li6Cu2C4SO16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35200620
_cell_length_b   9.35200620
_cell_length_c   9.35200620
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Cu2C4SO16
_chemical_formula_sum   'Li12 Cu4 C8 S2 O32'
_cell_volume   578.36147954
_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  0.21965200  0.78034800  0.78034800  1
  Li  Li1  1  0.21965200  0.78034800  0.21965200  1
  Li  Li2  1  0.21965200  0.21965200  0.78034800  1
  Li  Li3  1  0.78034800  0.78034800  0.21965200  1
  Li  Li4  1  0.46965200  0.03034800  0.03034800  1
  Li  Li5  1  0.46965200  0.03034800  0.46965200  1
  Li  Li6  1  0.78034800  0.21965200  0.78034800  1
  Li  Li7  1  0.78034800  0.21965200  0.21965200  1
  Li  Li8  1  0.03034800  0.03034800  0.46965200  1
  Li  Li9  1  0.46965200  0.46965200  0.03034800  1
  Li  Li10  1  0.03034800  0.46965200  0.46965200  1
  Li  Li11  1  0.03034800  0.46965200  0.03034800  1
  Cu  Cu12  1  0.12500000  0.62500000  0.62500000  1
  Cu  Cu13  1  0.62500000  0.62500000  0.12500000  1
  Cu  Cu14  1  0.62500000  0.62500000  0.62500000  1
  Cu  Cu15  1  0.62500000  0.12500000  0.62500000  1
  C  C16  1  0.40084300  0.79747200  0.40084300  1
  C  C17  1  0.40084300  0.40084300  0.40084300  1
  C  C18  1  0.40084300  0.40084300  0.79747200  1
  C  C19  1  0.79747200  0.40084300  0.40084300  1
  C  C20  1  0.45252800  0.84915700  0.84915700  1
  C  C21  1  0.84915700  0.84915700  0.45252800  1
  C  C22  1  0.84915700  0.84915700  0.84915700  1
  C  C23  1  0.84915700  0.45252800  0.84915700  1
  S  S24  1  0.25000000  0.25000000  0.25000000  1
  S  S25  1  0.00000000  0.00000000  0.00000000  1
  O  O26  1  0.18477200  0.44568400  0.18477200  1
  O  O27  1  0.18477200  0.18477200  0.44568400  1
  O  O28  1  0.18477200  0.18477200  0.18477200  1
  O  O29  1  0.44568400  0.18477200  0.18477200  1
  O  O30  1  0.25679400  0.79912800  0.53365200  1
  O  O31  1  0.41042700  0.79912800  0.25679400  1
  O  O32  1  0.25679400  0.53365200  0.41042700  1
  O  O33  1  0.53365200  0.79912800  0.41042700  1
  O  O34  1  0.25679400  0.41042700  0.79912800  1
  O  O35  1  0.41042700  0.53365200  0.79912800  1
  O  O36  1  0.53365200  0.41042700  0.25679400  1
  O  O37  1  0.41042700  0.25679400  0.53365200  1
  O  O38  1  0.79912800  0.53365200  0.25679400  1
  O  O39  1  0.53365200  0.25679400  0.79912800  1
  O  O40  1  0.79912800  0.41042700  0.53365200  1
  O  O41  1  0.45087200  0.99320600  0.83957300  1
  O  O42  1  0.79912800  0.25679400  0.41042700  1
  O  O43  1  0.45087200  0.83957300  0.71634800  1
  O  O44  1  0.71634800  0.99320600  0.45087200  1
  O  O45  1  0.45087200  0.71634800  0.99320600  1
  O  O46  1  0.83957300  0.99320600  0.71634800  1
  O  O47  1  0.71634800  0.83957300  0.99320600  1
  O  O48  1  0.83957300  0.71634800  0.45087200  1
  O  O49  1  0.99320600  0.83957300  0.45087200  1
  O  O50  1  0.71634800  0.45087200  0.83957300  1
  O  O51  1  0.99320600  0.71634800  0.83957300  1
  O  O52  1  0.83957300  0.45087200  0.99320600  1
  O  O53  1  0.99320600  0.45087200  0.71634800  1
  O  O54  1  0.80431600  0.06522800  0.06522800  1
  O  O55  1  0.06522800  0.06522800  0.06522800  1
  O  O56  1  0.06522800  0.06522800  0.80431600  1
  O  O57  1  0.06522800  0.80431600  0.06522800  1
