# generated using pymatgen
data_LiCu2(SO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.59729986
_cell_length_b   8.59729986
_cell_length_c   8.59729940
_cell_angle_alpha   60.01690388
_cell_angle_beta   60.01690388
_cell_angle_gamma   60.01690087
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCu2(SO4)3
_chemical_formula_sum   'Li2 Cu4 S6 O24'
_cell_volume   449.50816768
_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  0.50000000  0.50000000  0.50000000  1
  Cu  Cu2  1  0.35476700  0.35476700  0.35476700  1
  Cu  Cu3  1  0.14523300  0.14523300  0.14523300  1
  Cu  Cu4  1  0.64523300  0.64523300  0.64523300  1
  Cu  Cu5  1  0.85476700  0.85476700  0.85476700  1
  S  S6  1  0.75000000  0.04589900  0.45410100  1
  S  S7  1  0.95410100  0.54589900  0.25000000  1
  S  S8  1  0.54589900  0.25000000  0.95410100  1
  S  S9  1  0.45410100  0.75000000  0.04589900  1
  S  S10  1  0.04589900  0.45410100  0.75000000  1
  S  S11  1  0.25000000  0.95410100  0.54589900  1
  O  O12  1  0.91086500  0.05791600  0.26838300  1
  O  O13  1  0.73161700  0.08913500  0.94208400  1
  O  O14  1  0.89308100  0.48583300  0.69458300  1
  O  O15  1  0.01416700  0.60691900  0.80541700  1
  O  O16  1  0.58913500  0.23161700  0.44208400  1
  O  O17  1  0.76838300  0.55791600  0.41086500  1
  O  O18  1  0.94208400  0.73161700  0.08913500  1
  O  O19  1  0.19458300  0.98583300  0.39308100  1
  O  O20  1  0.51416700  0.30541700  0.10691900  1
  O  O21  1  0.30541700  0.10691900  0.51416700  1
  O  O22  1  0.39308100  0.19458300  0.98583300  1
  O  O23  1  0.55791600  0.41086500  0.76838300  1
  O  O24  1  0.44208400  0.58913500  0.23161700  1
  O  O25  1  0.69458300  0.89308100  0.48583300  1
  O  O26  1  0.60691900  0.80541700  0.01416700  1
  O  O27  1  0.80541700  0.01416700  0.60691900  1
  O  O28  1  0.48583300  0.69458300  0.89308100  1
  O  O29  1  0.05791600  0.26838300  0.91086500  1
  O  O30  1  0.23161700  0.44208400  0.58913500  1
  O  O31  1  0.41086500  0.76838300  0.55791600  1
  O  O32  1  0.10691900  0.51416700  0.30541700  1
  O  O33  1  0.98583300  0.39308100  0.19458300  1
  O  O34  1  0.26838300  0.91086500  0.05791600  1
  O  O35  1  0.08913500  0.94208400  0.73161700  1
