# generated using pymatgen
data_MgTe4Mo4(SeS)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.41585111
_cell_length_b   3.41585062
_cell_length_c   42.42576507
_cell_angle_alpha   90.15087513
_cell_angle_beta   89.85083485
_cell_angle_gamma   120.00332021
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTe4Mo4(SeS)2
_chemical_formula_sum   'Mg1 Te4 Mo4 Se2 S2'
_cell_volume   428.68826996
_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  0.66351600  0.33657500  0.36546400  1.0
  Te  Te1  1  0.33233900  0.66778500  0.70151800  1.0
  Te  Te2  1  0.66763600  0.33223500  0.04991200  1.0
  Te  Te3  1  0.66564400  0.33427300  0.13795700  1.0
  Te  Te4  1  0.33441200  0.66566500  0.61357900  1.0
  Mo  Mo5  1  0.33329800  0.66660500  0.09392400  1.0
  Mo  Mo6  1  0.33349000  0.66646200  0.47334700  1.0
  Mo  Mo7  1  0.66553800  0.33447700  0.27706200  1.0
  Mo  Mo8  1  0.66677100  0.33331000  0.65754500  1.0
  Se  Se9  1  0.66772800  0.33220100  0.43444400  1.0
  Se  Se10  1  0.66599300  0.33400100  0.51194500  1.0
  S  S11  1  0.33163800  0.66841500  0.31266400  1.0
  S  S12  1  0.33271100  0.66728200  0.24223400  1.0