# generated using pymatgen
data_Hf3Sc3(Nb2Si3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80250082
_cell_length_b   7.79563304
_cell_length_c   5.38428787
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.02912304
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Sc3(Nb2Si3)2
_chemical_formula_sum   'Hf3 Sc3 Nb4 Si6'
_cell_volume   283.54147178
_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  0.74688780  0.74859752  0.25000000  1.0
  Hf  Hf1  1  0.99829137  0.25140149  0.25000000  1.0
  Hf  Hf2  1  0.74814343  0.00000076  0.75000000  1.0
  Sc  Sc3  1  0.25122185  0.00000065  0.25000000  1.0
  Sc  Sc4  1  0.99949220  0.74901208  0.75000000  1.0
  Sc  Sc5  1  0.25047545  0.25098301  0.75000000  1.0
  Nb  Nb6  1  0.33454317  0.66658950  0.99996123  1.0
  Nb  Nb7  1  0.66795491  0.33341110  0.99996133  1.0
  Nb  Nb8  1  0.33454317  0.66658950  0.50003877  1.0
  Nb  Nb9  1  0.66795491  0.33341110  0.50003867  1.0
  Si  Si10  1  0.60576462  0.60563193  0.75000000  1.0
  Si  Si11  1  0.39584900  0.00000020  0.75000000  1.0
  Si  Si12  1  0.60504781  0.00000021  0.25000000  1.0
  Si  Si13  1  0.00013358  0.39437015  0.75000000  1.0
  Si  Si14  1  0.39393213  0.39416836  0.25000000  1.0
  Si  Si15  1  0.99976462  0.60583243  0.25000000  1.0