# generated using pymatgen
data_HfSc(SiMo)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.48005029
_cell_length_b   6.99137358
_cell_length_c   8.19381851
_cell_angle_alpha   89.99189495
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc(SiMo)2
_chemical_formula_sum   'Hf2 Sc2 Si4 Mo4'
_cell_volume   199.35832024
_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
  Hf  Hf0  1  0.25000000  0.54264700  0.16603745  1.0
  Hf  Hf1  1  0.75000000  0.45735300  0.83396255  1.0
  Sc  Sc2  1  0.25000000  0.04339171  0.33361711  1.0
  Sc  Sc3  1  0.75000000  0.95660829  0.66638289  1.0
  Si  Si4  1  0.25000000  0.25895048  0.63666972  1.0
  Si  Si5  1  0.75000000  0.74104952  0.36333028  1.0
  Si  Si6  1  0.25000000  0.75763905  0.86326567  1.0
  Si  Si7  1  0.75000000  0.24236095  0.13673433  1.0
  Mo  Mo8  1  0.75000000  0.37137689  0.43822695  1.0
  Mo  Mo9  1  0.25000000  0.62862311  0.56177305  1.0
  Mo  Mo10  1  0.75000000  0.86818642  0.06210207  1.0
  Mo  Mo11  1  0.25000000  0.13181358  0.93789793  1.0