# generated using pymatgen
data_Li(ZrS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.46183033
_cell_length_b   7.46183075
_cell_length_c   7.46183028
_cell_angle_alpha   59.99999771
_cell_angle_beta   59.99999584
_cell_angle_gamma   59.99999655
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(ZrS2)4
_chemical_formula_sum   'Li1 Zr4 S8'
_cell_volume   293.77923814
_cell_formula_units_Z   1
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  0.75000000  0.75000000  0.75000000  1.0
  Zr  Zr1  1  0.61720861  0.12759746  0.12759746  1.0
  Zr  Zr2  1  0.12759746  0.61720861  0.12759746  1.0
  Zr  Zr3  1  0.12759746  0.12759746  0.61720861  1.0
  Zr  Zr4  1  0.12759746  0.12759746  0.12759746  1.0
  S  S5  1  0.35525249  0.88158217  0.88158217  1.0
  S  S6  1  0.88158217  0.35525249  0.88158217  1.0
  S  S7  1  0.88158217  0.88158217  0.35525249  1.0
  S  S8  1  0.88158217  0.88158217  0.88158217  1.0
  S  S9  1  0.89048583  0.36983806  0.36983806  1.0
  S  S10  1  0.36983806  0.89048583  0.36983806  1.0
  S  S11  1  0.36983806  0.36983806  0.89048583  1.0
  S  S12  1  0.36983806  0.36983806  0.36983806  1.0