# generated using pymatgen
data_Mg(TiS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.32446236
_cell_length_b   7.32446236
_cell_length_c   7.32446236
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(TiS2)2
_chemical_formula_sum   'Mg2 Ti4 S8'
_cell_volume   277.85118666
_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  0.50000000  1.0
  Mg  Mg1  1  0.75000000  0.75000000  0.75000000  1.0
  Ti  Ti2  1  0.12500000  0.12500000  0.12500000  1.0
  Ti  Ti3  1  0.62500000  0.12500000  0.12500000  1.0
  Ti  Ti4  1  0.12500000  0.62500000  0.12500000  1.0
  Ti  Ti5  1  0.12500000  0.12500000  0.62500000  1.0
  S  S6  1  0.36572500  0.36572500  0.36572500  1.0
  S  S7  1  0.34717500  0.88427500  0.88427500  1.0
  S  S8  1  0.88427500  0.88427500  0.34717500  1.0
  S  S9  1  0.88427500  0.34717500  0.88427500  1.0
  S  S10  1  0.36572500  0.36572500  0.90282500  1.0
  S  S11  1  0.36572500  0.90282500  0.36572500  1.0
  S  S12  1  0.88427500  0.88427500  0.88427500  1.0
  S  S13  1  0.90282500  0.36572500  0.36572500  1.0