# generated using pymatgen
data_Hf3Sc(SiMo)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.48686485
_cell_length_b   6.94522678
_cell_length_c   8.18322407
_cell_angle_alpha   90.18675139
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Sc(SiMo)4
_chemical_formula_sum   'Hf3 Sc1 Si4 Mo4'
_cell_volume   198.17263389
_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
  Hf  Hf0  1  0.75000000  0.95649809  0.66898532  1.0
  Hf  Hf1  1  0.25000000  0.54350981  0.16556454  1.0
  Hf  Hf2  1  0.75000000  0.45591990  0.83327609  1.0
  Sc  Sc3  1  0.25000000  0.04265810  0.33364519  1.0
  Si  Si4  1  0.25000000  0.25795582  0.63563361  1.0
  Si  Si5  1  0.75000000  0.74169116  0.36225534  1.0
  Si  Si6  1  0.25000000  0.75644480  0.86415133  1.0
  Si  Si7  1  0.75000000  0.24184889  0.13723129  1.0
  Mo  Mo8  1  0.75000000  0.37007902  0.43875778  1.0
  Mo  Mo9  1  0.25000000  0.63350743  0.56262305  1.0
  Mo  Mo10  1  0.75000000  0.86612571  0.06204463  1.0
  Mo  Mo11  1  0.25000000  0.13376126  0.93583182  1.0