# generated using pymatgen
data_YbHf(NbS2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83122838
_cell_length_b   5.83122780
_cell_length_c   13.42541545
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000326
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbHf(NbS2)6
_chemical_formula_sum   'Yb1 Hf1 Nb6 S12'
_cell_volume   395.34696541
_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
  Yb  Yb0  1  0.33333300  0.66666700  0.25000000  1.0
  Hf  Hf1  1  0.66666700  0.33333300  0.75000000  1.0
  Nb  Nb2  1  0.33333300  0.66666700  0.51379878  1.0
  Nb  Nb3  1  0.66666700  0.33333300  0.98806076  1.0
  Nb  Nb4  1  0.66666700  0.33333300  0.51193924  1.0
  Nb  Nb5  1  0.33333300  0.66666700  0.98620122  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.51330911  1.0
  Nb  Nb7  1  0.00000000  0.00000000  0.98669089  1.0
  S  S8  1  0.33161170  0.33121034  0.10404419  1.0
  S  S9  1  0.66878966  0.00040136  0.10404419  1.0
  S  S10  1  0.99959864  0.66838830  0.10404419  1.0
  S  S11  1  0.00171929  0.33277968  0.63159198  1.0
  S  S12  1  0.66722032  0.99828071  0.86840802  1.0
  S  S13  1  0.66722032  0.66893961  0.63159198  1.0
  S  S14  1  0.33106039  0.99828071  0.63159198  1.0
  S  S15  1  0.66878966  0.66838830  0.39595581  1.0
  S  S16  1  0.33161170  0.00040136  0.39595581  1.0
  S  S17  1  0.33106039  0.33277968  0.86840802  1.0
  S  S18  1  0.00171929  0.66893961  0.86840802  1.0
  S  S19  1  0.99959864  0.33121034  0.39595581  1.0