# generated using pymatgen
data_NdHfReB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64153225
_cell_length_b   9.07098959
_cell_length_c   11.52016199
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdHfReB6
_chemical_formula_sum   'Nd4 Hf4 Re4 B24'
_cell_volume   380.53745966
_cell_formula_units_Z   4
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
  Nd  Nd0  1  0.00000000  0.32264067  0.41457941  1.0
  Nd  Nd1  1  0.00000000  0.67735933  0.58542059  1.0
  Nd  Nd2  1  0.00000000  0.82264067  0.08542059  1.0
  Nd  Nd3  1  0.00000000  0.17735933  0.91457941  1.0
  Hf  Hf4  1  0.00000000  0.94613911  0.37246517  1.0
  Hf  Hf5  1  0.00000000  0.05386089  0.62753483  1.0
  Hf  Hf6  1  0.00000000  0.44613911  0.12753483  1.0
  Hf  Hf7  1  0.00000000  0.55386089  0.87246517  1.0
  Re  Re8  1  0.00000000  0.64267356  0.31602019  1.0
  Re  Re9  1  0.00000000  0.35732644  0.68397981  1.0
  Re  Re10  1  0.00000000  0.14267356  0.18397981  1.0
  Re  Re11  1  0.00000000  0.85732644  0.81602019  1.0
  B  B12  1  0.50000000  0.55701683  0.42965063  1.0
  B  B13  1  0.50000000  0.44298317  0.57034937  1.0
  B  B14  1  0.50000000  0.05701683  0.07034937  1.0
  B  B15  1  0.50000000  0.94298317  0.92965063  1.0
  B  B16  1  0.50000000  0.75410098  0.41543486  1.0
  B  B17  1  0.50000000  0.24589902  0.58456514  1.0
  B  B18  1  0.50000000  0.25410098  0.08456514  1.0
  B  B19  1  0.50000000  0.74589902  0.91543486  1.0
  B  B20  1  0.50000000  0.79563477  0.26503977  1.0
  B  B21  1  0.50000000  0.20436523  0.73496023  1.0
  B  B22  1  0.50000000  0.29563477  0.23496023  1.0
  B  B23  1  0.50000000  0.70436523  0.76503977  1.0
  B  B24  1  0.50000000  0.62971405  0.18317594  1.0
  B  B25  1  0.50000000  0.37028595  0.81682406  1.0
  B  B26  1  0.50000000  0.12971405  0.31682406  1.0
  B  B27  1  0.50000000  0.87028595  0.68317594  1.0
  B  B28  1  0.50000000  0.98406836  0.21554617  1.0
  B  B29  1  0.50000000  0.01593164  0.78445383  1.0
  B  B30  1  0.50000000  0.48406836  0.28445383  1.0
  B  B31  1  0.50000000  0.51593164  0.71554617  1.0
  B  B32  1  0.50000000  0.59791408  0.02565899  1.0
  B  B33  1  0.50000000  0.40208592  0.97434101  1.0
  B  B34  1  0.50000000  0.09791408  0.47434101  1.0
  B  B35  1  0.50000000  0.90208592  0.52565899  1.0