# generated using pymatgen
data_Er(Mo3S4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46806319
_cell_length_b   6.46801740
_cell_length_c   6.46809590
_cell_angle_alpha   89.62819805
_cell_angle_beta   89.62797701
_cell_angle_gamma   89.62865694
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er(Mo3S4)2
_chemical_formula_sum   'Er1 Mo6 S8'
_cell_volume   270.57930776
_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
  Er  Er0  1  0.99996264  0.00005422  0.99999568  1.0
  Mo  Mo1  1  0.77426765  0.57987768  0.44034271  1.0
  Mo  Mo2  1  0.44033928  0.77427443  0.57988571  1.0
  Mo  Mo3  1  0.57987871  0.44033755  0.77425403  1.0
  Mo  Mo4  1  0.22574113  0.42011640  0.55965572  1.0
  Mo  Mo5  1  0.55966061  0.22571864  0.42011721  1.0
  Mo  Mo6  1  0.42012327  0.55965124  0.22574794  1.0
  S  S7  1  0.76287896  0.76288841  0.76287653  1.0
  S  S8  1  0.23712929  0.23710644  0.23712618  1.0
  S  S9  1  0.24791321  0.63264686  0.87277118  1.0
  S  S10  1  0.87277703  0.24789834  0.63263190  1.0
  S  S11  1  0.63264385  0.87277795  0.24792003  1.0
  S  S12  1  0.75209329  0.36734199  0.12723407  1.0
  S  S13  1  0.12723533  0.75209028  0.36736115  1.0
  S  S14  1  0.36735575  0.12721759  0.75208098  1.0