# generated using pymatgen
data_Hf4Sc(ReTc)12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39486008
_cell_length_b   8.39486057
_cell_length_c   8.39486086
_cell_angle_alpha   109.47121897
_cell_angle_beta   109.47122016
_cell_angle_gamma   109.47122661
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf4Sc(ReTc)12
_chemical_formula_sum   'Hf4 Sc1 Re12 Tc12'
_cell_volume   455.42675476
_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  0.62670354  1.00000000  1.00000000  1.0
  Hf  Hf1  1  1.00000000  0.62670354  1.00000000  1.0
  Hf  Hf2  1  0.00000000  0.00000000  0.62670354  1.0
  Hf  Hf3  1  0.37329646  0.37329646  0.37329646  1.0
  Sc  Sc4  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re5  1  0.37625385  0.19404050  0.00000000  1.0
  Re  Re6  1  0.18221436  0.80595950  0.80595950  1.0
  Re  Re7  1  0.37625385  0.00000000  0.19404050  1.0
  Re  Re8  1  0.19404050  0.37625385  0.00000000  1.0
  Re  Re9  1  1.00000000  0.37625385  0.19404050  1.0
  Re  Re10  1  0.80595950  0.18221436  0.80595950  1.0
  Re  Re11  1  0.80595950  0.80595950  0.18221436  1.0
  Re  Re12  1  0.00000000  0.19404050  0.37625385  1.0
  Re  Re13  1  0.19404050  0.00000000  0.37625385  1.0
  Re  Re14  1  0.62374615  0.62374615  0.81778564  1.0
  Re  Re15  1  0.81778564  0.62374615  0.62374615  1.0
  Re  Re16  1  0.62374615  0.81778564  0.62374615  1.0
  Tc  Tc17  1  0.39665848  0.67602225  1.00000000  1.0
  Tc  Tc18  1  0.72063723  0.32397775  0.32397775  1.0
  Tc  Tc19  1  0.39665848  1.00000000  0.67602225  1.0
  Tc  Tc20  1  0.67602225  0.39665848  1.00000000  1.0
  Tc  Tc21  1  0.00000000  0.39665848  0.67602225  1.0
  Tc  Tc22  1  0.32397775  0.72063723  0.32397775  1.0
  Tc  Tc23  1  0.32397775  0.32397775  0.72063723  1.0
  Tc  Tc24  1  1.00000000  0.67602225  0.39665848  1.0
  Tc  Tc25  1  0.67602225  1.00000000  0.39665848  1.0
  Tc  Tc26  1  0.60334152  0.60334152  0.27936277  1.0
  Tc  Tc27  1  0.27936277  0.60334152  0.60334152  1.0
  Tc  Tc28  1  0.60334152  0.27936277  0.60334152  1.0