# generated using pymatgen
data_Ce2Re3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.20374166
_cell_length_b   5.20374204
_cell_length_c   9.58362329
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999134
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce2Re3Ru
_chemical_formula_sum   'Ce4 Re6 Ru2'
_cell_volume   224.74595914
_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
  Ce  Ce0  1  0.33333300  0.66666700  0.94181317  1.0
  Ce  Ce1  1  0.66666700  0.33333300  0.05818683  1.0
  Ce  Ce2  1  0.66666700  0.33333300  0.44181317  1.0
  Ce  Ce3  1  0.33333300  0.66666700  0.55818683  1.0
  Re  Re4  1  0.83097093  0.16902907  0.75000000  1.0
  Re  Re5  1  0.83097093  0.66194185  0.75000000  1.0
  Re  Re6  1  0.33805815  0.16902907  0.75000000  1.0
  Re  Re7  1  0.16902907  0.83097093  0.25000000  1.0
  Re  Re8  1  0.16902907  0.33805815  0.25000000  1.0
  Re  Re9  1  0.66194185  0.83097093  0.25000000  1.0
  Ru  Ru10  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru11  1  0.00000000  0.00000000  0.50000000  1.0