# generated using pymatgen
data_Li7NbS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55339200
_cell_length_b   7.13458600
_cell_length_c   12.24329612
_cell_angle_alpha   55.58565694
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li7NbS6
_chemical_formula_sum   'Li14 Nb2 S12'
_cell_volume   544.31259729
_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  0.09869400  0.40108300  0.70708900  1
  Li  Li1  1  0.47799800  0.44386500  0.68304500  1
  Li  Li2  1  0.87155900  0.24951700  0.96949500  1
  Li  Li3  1  0.86036400  0.55962300  0.51153100  1
  Li  Li4  1  0.05816300  0.95087000  0.29750100  1
  Li  Li5  1  0.36512700  0.91360000  0.41645500  1
  Li  Li6  1  0.74143100  0.62400400  0.77136100  1
  Li  Li7  1  0.90130600  0.40108300  0.20708900  1
  Li  Li8  1  0.52200200  0.44386500  0.18304500  1
  Li  Li9  1  0.12844100  0.24951700  0.46949500  1
  Li  Li10  1  0.13963600  0.55962300  0.01153100  1
  Li  Li11  1  0.94183700  0.95087000  0.79750100  1
  Li  Li12  1  0.63487300  0.91360000  0.91645500  1
  Li  Li13  1  0.25856900  0.62400400  0.27136100  1
  Nb  Nb14  1  0.26626400  0.04055200  0.98655400  1
  Nb  Nb15  1  0.73373600  0.04055200  0.48655400  1
  S  S16  1  0.78229600  0.29073900  0.75864300  1
  S  S17  1  0.19158800  0.57760500  0.47893300  1
  S  S18  1  0.01989600  0.88408900  0.11821900  1
  S  S19  1  0.26630400  0.42598900  0.87457400  1
  S  S20  1  0.73424200  0.96919300  0.32712800  1
  S  S21  1  0.49218500  0.86020000  0.61800700  1
  S  S22  1  0.80841200  0.57760500  0.97893300  1
  S  S23  1  0.98010400  0.88408900  0.61821900  1
  S  S24  1  0.21770400  0.29073900  0.25864300  1
  S  S25  1  0.26575800  0.96919300  0.82712800  1
  S  S26  1  0.73369600  0.42598900  0.37457400  1
  S  S27  1  0.50781500  0.86020000  0.11800700  1
