# generated using pymatgen
data_Li8NbS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96355429
_cell_length_b   6.96355429
_cell_length_c   13.48645900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000276
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8NbS6
_chemical_formula_sum   'Li16 Nb2 S12'
_cell_volume   566.35728057
_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  0.68099100  0.76572300  1.0
  Li  Li1  1  0.00000000  0.62261200  0.13135700  1.0
  Li  Li2  1  0.00000000  0.37738800  0.63135700  1.0
  Li  Li3  1  0.00000000  0.31900900  0.26572300  1.0
  Li  Li4  1  0.33333300  0.66666700  0.39950500  1.0
  Li  Li5  1  0.33333300  0.66666700  0.89950500  1.0
  Li  Li6  1  0.31900900  0.31900900  0.76572300  1.0
  Li  Li7  1  0.37738800  0.37738800  0.13135700  1.0
  Li  Li8  1  0.62261200  0.62261200  0.63135700  1.0
  Li  Li9  1  0.31900900  0.00000000  0.26572300  1.0
  Li  Li10  1  0.68099100  0.68099100  0.26572300  1.0
  Li  Li11  1  0.37738800  0.00000000  0.63135700  1.0
  Li  Li12  1  0.66666700  0.33333300  0.89950500  1.0
  Li  Li13  1  0.66666700  0.33333300  0.39950500  1.0
  Li  Li14  1  0.62261200  0.00000000  0.13135700  1.0
  Li  Li15  1  0.68099100  0.00000000  0.76572300  1.0
  Nb  Nb16  1  0.00000000  0.00000000  0.99801000  1.0
  Nb  Nb17  1  0.00000000  0.00000000  0.49801000  1.0
  S  S18  1  0.00000000  0.67809800  0.94993300  1.0
  S  S19  1  0.00000000  0.32190200  0.44993300  1.0
  S  S20  1  0.33333300  0.66666700  0.21567500  1.0
  S  S21  1  0.00000000  0.00000000  0.17542900  1.0
  S  S22  1  0.00000000  0.00000000  0.67542900  1.0
  S  S23  1  0.33333300  0.66666700  0.71567500  1.0
  S  S24  1  0.32190200  0.32190200  0.94993300  1.0
  S  S25  1  0.32190200  0.00000000  0.44993300  1.0
  S  S26  1  0.67809800  0.67809800  0.44993300  1.0
  S  S27  1  0.66666700  0.33333300  0.71567500  1.0
  S  S28  1  0.66666700  0.33333300  0.21567500  1.0
  S  S29  1  0.67809800  0.00000000  0.94993300  1.0