# generated using pymatgen
data_MnNb7S12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82909979
_cell_length_b   5.82910422
_cell_length_c   12.70277883
_cell_angle_alpha   89.99986854
_cell_angle_beta   90.00010748
_cell_angle_gamma   119.99983786
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnNb7S12
_chemical_formula_sum   'Mn1 Nb7 S12'
_cell_volume   373.79491396
_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
  Mn  Mn0  1  0.33332885  0.66667009  0.24994255  1.0
  Nb  Nb1  1  0.00000089  0.00000084  0.50028674  1.0
  Nb  Nb2  1  0.99999953  0.99999937  0.99970950  1.0
  Nb  Nb3  1  0.33333363  0.66666653  0.99863493  1.0
  Nb  Nb4  1  0.66666685  0.33333358  0.00151789  1.0
  Nb  Nb5  1  0.66666660  0.33333228  0.49848277  1.0
  Nb  Nb6  1  0.33333284  0.66666543  0.50135878  1.0
  Nb  Nb7  1  0.66666754  0.33333341  0.75005472  1.0
  S  S8  1  0.33161565  0.33082427  0.37610856  1.0
  S  S9  1  0.66917428  0.00078782  0.37610959  1.0
  S  S10  1  0.99920819  0.66838539  0.37610898  1.0
  S  S11  1  0.33264209  0.33267809  0.62391734  1.0
  S  S12  1  0.00003676  0.66735830  0.62391732  1.0
  S  S13  1  0.66732203  0.99996335  0.62391698  1.0
  S  S14  1  0.66732147  0.66736373  0.87612904  1.0
  S  S15  1  0.33263880  0.99996150  0.87612939  1.0
  S  S16  1  0.00004399  0.33267912  0.87612909  1.0
  S  S17  1  0.66916623  0.66838651  0.12384892  1.0
  S  S18  1  0.99921940  0.33083207  0.12384832  1.0
  S  S19  1  0.33161238  0.00078031  0.12384860  1.0