# generated using pymatgen
data_NdNbP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35115715
_cell_length_b   9.35115696
_cell_length_c   3.89724313
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdNbP7Ru12
_chemical_formula_sum   'Nd1 Nb1 P7 Ru12'
_cell_volume   295.13371200
_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  0.00000000  1.0
  Nb  Nb1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.60290330  0.71927858  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28072142  0.88362471  0.50000000  1.0
  P  P5  1  0.11637529  0.39709670  0.50000000  1.0
  P  P6  1  0.88700441  0.57109505  0.00000000  1.0
  P  P7  1  0.42890495  0.31591036  0.00000000  1.0
  P  P8  1  0.68408964  0.11299559  0.00000000  1.0
  Ru  Ru9  1  0.56165891  0.96258821  0.50000000  1.0
  Ru  Ru10  1  0.40092929  0.43834109  0.50000000  1.0
  Ru  Ru11  1  0.91460432  0.12130514  0.50000000  1.0
  Ru  Ru12  1  0.20670082  0.08539568  0.50000000  1.0
  Ru  Ru13  1  0.87869486  0.79329918  0.50000000  1.0
  Ru  Ru14  1  0.72660116  0.88948937  0.00000000  1.0
  Ru  Ru15  1  0.11051063  0.83710979  0.00000000  1.0
  Ru  Ru16  1  0.16289021  0.27339884  0.00000000  1.0
  Ru  Ru17  1  0.42854770  0.07970819  0.00000000  1.0
  Ru  Ru18  1  0.92029181  0.34884051  0.00000000  1.0
  Ru  Ru19  1  0.65115949  0.57145230  0.00000000  1.0
  Ru  Ru20  1  0.03741179  0.59907071  0.50000000  1.0