# generated using pymatgen
data_TmHfFeB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.40344631
_cell_length_b   8.88009713
_cell_length_c   11.21778313
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmHfFeB6
_chemical_formula_sum   'Tm4 Hf4 Fe4 B24'
_cell_volume   339.03431670
_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
  Tm  Tm0  1  0.00000000  0.82304694  0.08563460  1.0
  Tm  Tm1  1  0.00000000  0.17695306  0.91436540  1.0
  Tm  Tm2  1  0.00000000  0.32304694  0.41436540  1.0
  Tm  Tm3  1  0.00000000  0.67695306  0.58563460  1.0
  Hf  Hf4  1  0.00000000  0.44427901  0.12849321  1.0
  Hf  Hf5  1  0.00000000  0.55572099  0.87150679  1.0
  Hf  Hf6  1  0.00000000  0.94427901  0.37150679  1.0
  Hf  Hf7  1  0.00000000  0.05572099  0.62849321  1.0
  Fe  Fe8  1  0.00000000  0.14339949  0.18269765  1.0
  Fe  Fe9  1  0.00000000  0.85660051  0.81730235  1.0
  Fe  Fe10  1  0.00000000  0.64339949  0.31730235  1.0
  Fe  Fe11  1  0.00000000  0.35660051  0.68269765  1.0
  B  B12  1  0.50000000  0.05437114  0.06750749  1.0
  B  B13  1  0.50000000  0.94562886  0.93249251  1.0
  B  B14  1  0.50000000  0.55437114  0.43249251  1.0
  B  B15  1  0.50000000  0.44562886  0.56750749  1.0
  B  B16  1  0.50000000  0.25012496  0.08314197  1.0
  B  B17  1  0.50000000  0.74987504  0.91685803  1.0
  B  B18  1  0.50000000  0.75012496  0.41685803  1.0
  B  B19  1  0.50000000  0.24987504  0.58314197  1.0
  B  B20  1  0.50000000  0.29473479  0.23660886  1.0
  B  B21  1  0.50000000  0.70526521  0.76339114  1.0
  B  B22  1  0.50000000  0.79473479  0.26339114  1.0
  B  B23  1  0.50000000  0.20526521  0.73660886  1.0
  B  B24  1  0.50000000  0.13179294  0.31622944  1.0
  B  B25  1  0.50000000  0.86820706  0.68377056  1.0
  B  B26  1  0.50000000  0.63179294  0.18377056  1.0
  B  B27  1  0.50000000  0.36820706  0.81622944  1.0
  B  B28  1  0.50000000  0.48432542  0.28808018  1.0
  B  B29  1  0.50000000  0.51567458  0.71191982  1.0
  B  B30  1  0.50000000  0.98432542  0.21191982  1.0
  B  B31  1  0.50000000  0.01567458  0.78808018  1.0
  B  B32  1  0.50000000  0.10176848  0.47297890  1.0
  B  B33  1  0.50000000  0.89823152  0.52702110  1.0
  B  B34  1  0.50000000  0.60176848  0.02702110  1.0
  B  B35  1  0.50000000  0.39823152  0.97297890  1.0