# generated using pymatgen
data_Hf3Si3MoRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64828609
_cell_length_b   7.64828580
_cell_length_c   7.64828641
_cell_angle_alpha   126.43065736
_cell_angle_beta   125.65802709
_cell_angle_gamma   79.81683066
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Si3MoRu2
_chemical_formula_sum   'Hf6 Si6 Mo2 Ru4'
_cell_volume   282.48635285
_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  0.45721221  0.67501368  0.71780146  1.0
  Hf  Hf1  1  0.54278779  0.26058925  0.21780146  1.0
  Hf  Hf2  1  0.74722649  0.84020619  0.59297969  1.0
  Hf  Hf3  1  0.25277351  0.84575220  0.09297969  1.0
  Hf  Hf4  1  0.05345789  0.25970496  0.70624607  1.0
  Hf  Hf5  1  0.94654211  0.65278819  0.20624607  1.0
  Si  Si6  1  0.26375324  0.25715738  0.49340414  1.0
  Si  Si7  1  0.73624676  0.22964889  0.99340414  1.0
  Si  Si8  1  0.32734085  0.58813490  0.25272880  1.0
  Si  Si9  1  0.67265915  0.92538795  0.26079405  1.0
  Si  Si10  1  0.16459390  0.92538795  0.75272880  1.0
  Si  Si11  1  0.83540610  0.58813490  0.76079405  1.0
  Mo  Mo12  1  0.50000000  0.50295952  0.00295952  1.0
  Mo  Mo13  1  0.00000000  0.50295952  0.50295952  1.0
  Ru  Ru14  1  0.10655351  0.25241991  0.10702187  1.0
  Ru  Ru15  1  0.89344649  0.00046835  0.14586740  1.0
  Ru  Ru16  1  0.35460096  0.00046835  0.60702187  1.0
  Ru  Ru17  1  0.64539904  0.25241991  0.64586740  1.0