# generated using pymatgen
data_MgTe4Mo4(SeS)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.41468918
_cell_length_b   3.41400183
_cell_length_c   42.56248247
_cell_angle_alpha   89.99258278
_cell_angle_beta   89.90986450
_cell_angle_gamma   119.99219305
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTe4Mo4(SeS)2
_chemical_formula_sum   'Mg1 Te4 Mo4 Se2 S2'
_cell_volume   429.74010922
_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
  Mg  Mg0  1  0.67250200  0.33620300  0.19722800  1.0
  Te  Te1  1  0.33176200  0.66594200  0.70164300  1.0
  Te  Te2  1  0.66816400  0.33413600  0.42529300  1.0
  Te  Te3  1  0.66510100  0.33244900  0.51310100  1.0
  Te  Te4  1  0.33487000  0.66762100  0.61390600  1.0
  Mo  Mo5  1  0.33375000  0.66676300  0.09051600  1.0
  Mo  Mo6  1  0.33326400  0.66662500  0.46921800  1.0
  Mo  Mo7  1  0.66832900  0.33419300  0.28699200  1.0
  Mo  Mo8  1  0.66672800  0.33347800  0.65777600  1.0
  Se  Se9  1  0.66873900  0.33433800  0.05195300  1.0
  Se  Se10  1  0.66548900  0.33254100  0.12929000  1.0
  S  S11  1  0.33461800  0.66729100  0.32177400  1.0
  S  S12  1  0.33525600  0.66770600  0.25144600  1.0