# generated using pymatgen
data_Mn(NbS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73513155
_cell_length_b   6.73513233
_cell_length_c   12.48918814
_cell_angle_alpha   90.00006016
_cell_angle_beta   89.99990714
_cell_angle_gamma   119.99981395
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(NbS2)4
_chemical_formula_sum   'Mn2 Nb8 S16'
_cell_volume   490.63425861
_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
  Mn  Mn0  1  0.00000005  -0.00000014  -0.00000222  1.0
  Mn  Mn1  1  -0.00000023  0.00000004  0.50000106  1.0
  Nb  Nb2  1  0.98620718  0.49310504  0.24994358  1.0
  Nb  Nb3  1  0.01379332  0.50689482  0.75006164  1.0
  Nb  Nb4  1  0.49310456  0.50689597  0.75006165  1.0
  Nb  Nb5  1  0.50689447  0.01379358  0.24994365  1.0
  Nb  Nb6  1  0.00000062  -0.00000103  0.75002612  1.0
  Nb  Nb7  1  -0.00000077  0.00000126  0.24997304  1.0
  Nb  Nb8  1  0.50689580  0.49310578  0.24994404  1.0
  Nb  Nb9  1  0.49310356  0.98620604  0.75006168  1.0
  S  S10  1  0.33333332  0.66666610  0.62140443  1.0
  S  S11  1  0.66666641  0.33333381  0.12130230  1.0
  S  S12  1  0.66666663  0.33333440  0.37861687  1.0
  S  S13  1  0.33333341  0.66666628  0.87868513  1.0
  S  S14  1  0.16802513  0.33605269  0.37438143  1.0
  S  S15  1  0.83196146  0.16803884  0.87441436  1.0
  S  S16  1  0.33607825  0.16803816  0.87441419  1.0
  S  S17  1  0.66394778  0.83197491  0.37438149  1.0
  S  S18  1  0.16802586  0.83197500  0.37438160  1.0
  S  S19  1  0.83196119  0.66392160  0.87441420  1.0
  S  S20  1  0.16803598  0.33607325  0.12556599  1.0
  S  S21  1  0.83196530  0.16803468  0.62563023  1.0
  S  S22  1  0.33607010  0.16803404  0.62563032  1.0
  S  S23  1  0.66392700  0.83196402  0.12556609  1.0
  S  S24  1  0.16803661  0.83196438  0.12556581  1.0
  S  S25  1  0.83196501  0.66392947  0.62563033  1.0