# generated using pymatgen
data_Hf3HgC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09406500
_cell_length_b   6.09406544
_cell_length_c   9.06657274
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   147.96484030
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3HgC
_chemical_formula_sum   'Hf6 Hg2 C2'
_cell_volume   178.60485560
_cell_formula_units_Z   2
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  0.87498666  0.12501334  0.04181820  1.0
  Hf  Hf1  1  0.53729257  0.46270743  0.25000000  1.0
  Hf  Hf2  1  0.87498666  0.12501334  0.45818180  1.0
  Hf  Hf3  1  0.12501334  0.87498666  0.54181820  1.0
  Hf  Hf4  1  0.46270743  0.53729257  0.75000000  1.0
  Hf  Hf5  1  0.12501334  0.87498666  0.95818080  1.0
  Hg  Hg6  1  0.24661751  0.75338249  0.25000000  1.0
  Hg  Hg7  1  0.75338249  0.24661751  0.75000000  1.0
  C  C8  1  0.50000000  0.50000000  0.00000000  1.0
  C  C9  1  0.50000000  0.50000000  0.50000000  1.0