# generated using pymatgen
data_Na(MnS2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.71351204
_cell_length_b   7.71351204
_cell_length_c   7.71351263
_cell_angle_alpha   45.08722913
_cell_angle_beta   45.08724643
_cell_angle_gamma   45.08723752
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na(MnS2)3
_chemical_formula_sum   'Na1 Mn3 S6'
_cell_volume   209.53397446
_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
  Na  Na0  1  0.00000000  0.00000000  0.00000000  1.0
  Mn  Mn1  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn2  1  0.16799376  0.16799376  0.16799376  1.0
  Mn  Mn3  1  0.83200624  0.83200624  0.83200624  1.0
  S  S4  1  0.56649675  0.22624410  0.89846243  1.0
  S  S5  1  0.89846243  0.56649675  0.22624410  1.0
  S  S6  1  0.22624410  0.89846243  0.56649675  1.0
  S  S7  1  0.77375590  0.10153757  0.43350325  1.0
  S  S8  1  0.10153757  0.43350325  0.77375590  1.0
  S  S9  1  0.43350325  0.77375590  0.10153757  1.0