# generated using pymatgen
data_Li(NiS)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68412899
_cell_length_b   3.68412899
_cell_length_c   5.96492400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998179
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(NiS)2
_chemical_formula_sum   'Li1 Ni2 S2'
_cell_volume   70.11408648
_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  0.00000000  0.00000000  0.00000000  1
  Ni  Ni1  1  0.33333300  0.66666700  0.36357300  1
  Ni  Ni2  1  0.66666700  0.33333300  0.63642700  1
  S  S3  1  0.33333300  0.66666700  0.74107800  1
  S  S4  1  0.66666700  0.33333300  0.25892200  1
