# generated using pymatgen
data_Mn2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73571172
_cell_length_b   5.73571172
_cell_length_c   15.94777670
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2S3
_chemical_formula_sum   'Mn12 S18'
_cell_volume   454.36556327
_cell_formula_units_Z   6
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  0.66666700  0.33333300  0.17535300  1
  Mn  Mn1  1  0.33333300  0.66666700  0.32464700  1
  Mn  Mn2  1  0.00000000  0.00000000  0.34202000  1
  Mn  Mn3  1  0.66666700  0.33333300  0.49131400  1
  Mn  Mn4  1  0.33333300  0.66666700  0.50868600  1
  Mn  Mn5  1  0.00000000  0.00000000  0.65798000  1
  Mn  Mn6  1  0.66666700  0.33333300  0.67535300  1
  Mn  Mn7  1  0.33333300  0.66666700  0.82464700  1
  Mn  Mn8  1  0.00000000  0.00000000  0.84202000  1
  Mn  Mn9  1  0.66666700  0.33333300  0.99131400  1
  Mn  Mn10  1  0.33333300  0.66666700  0.00868600  1
  Mn  Mn11  1  0.00000000  0.00000000  0.15798000  1
  S  S12  1  0.32007400  0.32007400  0.25000000  1
  S  S13  1  0.67992600  0.00000000  0.25000000  1
  S  S14  1  0.00000000  0.67992600  0.25000000  1
  S  S15  1  0.33333300  0.98674100  0.41666700  1
  S  S16  1  0.65340700  0.66666700  0.41666700  1
  S  S17  1  0.01325900  0.34659300  0.41666700  1
  S  S18  1  0.98674100  0.65340700  0.58333300  1
  S  S19  1  0.34659300  0.33333300  0.58333300  1
  S  S20  1  0.66666700  0.01325900  0.58333300  1
  S  S21  1  -0.00000000  0.32007400  0.75000000  1
  S  S22  1  0.32007400  0.00000000  0.75000000  1
  S  S23  1  0.67992600  0.67992600  0.75000000  1
  S  S24  1  0.65340700  0.98674100  0.91666700  1
  S  S25  1  0.01325900  0.66666700  0.91666700  1
  S  S26  1  0.33333300  0.34659300  0.91666700  1
  S  S27  1  0.66666700  0.65340700  0.08333300  1
  S  S28  1  0.98674100  0.33333300  0.08333300  1
  S  S29  1  0.34659300  0.01325900  0.08333300  1
