# generated using pymatgen
data_Nd3Y(NbRu3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81038457
_cell_length_b   5.81038404
_cell_length_c   7.93360999
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Y(NbRu3)2
_chemical_formula_sum   'Nd3 Y1 Nb2 Ru6'
_cell_volume   231.95900196
_cell_formula_units_Z   1
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  0.33333300  0.66666700  0.44151474  1.0
  Nd  Nd1  1  0.66666700  0.33333300  0.56087239  1.0
  Nd  Nd2  1  0.66666700  0.33333300  0.94122845  1.0
  Y  Y3  1  0.33333300  0.66666700  0.05972430  1.0
  Nb  Nb4  1  0.00000000  0.00000000  0.99774816  1.0
  Nb  Nb5  1  0.00000000  0.00000000  0.49612849  1.0
  Ru  Ru6  1  0.16978364  0.33956628  0.75159696  1.0
  Ru  Ru7  1  0.16978364  0.83021636  0.75159696  1.0
  Ru  Ru8  1  0.33884894  0.16942497  0.24933153  1.0
  Ru  Ru9  1  0.83057503  0.66115106  0.24933153  1.0
  Ru  Ru10  1  0.66043372  0.83021636  0.75159696  1.0
  Ru  Ru11  1  0.83057503  0.16942497  0.24933153  1.0