# generated using pymatgen
data_Mg(MnS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37460842
_cell_length_b   7.37460842
_cell_length_c   7.37460842
_cell_angle_alpha   121.82697554
_cell_angle_beta   121.82697554
_cell_angle_gamma   86.86368140
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(MnS2)2
_chemical_formula_sum   'Mg2 Mn4 S8'
_cell_volume   275.31701223
_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
  Mg  Mg0  1  0.50000000  0.50000000  0.00000000  1.0
  Mg  Mg1  1  0.25000000  0.75000000  0.50000000  1.0
  Mn  Mn2  1  0.87500000  0.12500000  0.25000000  1.0
  Mn  Mn3  1  0.37500000  0.12500000  0.25000000  1.0
  Mn  Mn4  1  0.87500000  0.62500000  0.75000000  1.0
  Mn  Mn5  1  0.87500000  0.12500000  0.75000000  1.0
  S  S6  1  0.66042600  0.88887500  0.77155100  1.0
  S  S7  1  0.11112500  0.88267600  0.77155100  1.0
  S  S8  1  0.11112500  0.33957400  0.22844900  1.0
  S  S9  1  0.08957400  0.36112500  0.72844900  1.0
  S  S10  1  0.63267600  0.36112500  0.27155100  1.0
  S  S11  1  0.63887500  0.36732400  0.72844900  1.0
  S  S12  1  0.11732400  0.88887500  0.22844900  1.0
  S  S13  1  0.63887500  0.91042600  0.27155100  1.0