# generated using pymatgen
data_Nb2VRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.14791213
_cell_length_b   10.14791213
_cell_length_c   10.14791213
_cell_angle_alpha   127.97508341
_cell_angle_beta   117.32224086
_cell_angle_gamma   85.73823915
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2VRu
_chemical_formula_sum   'Nb2 V1 Ru1'
_cell_volume   698.81452336
_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
  Nb  Nb0  1  0.00000000  0.24869700  0.24869700  1.0
  Nb  Nb1  1  0.00000000  0.75130300  0.75130300  1.0
  V  V2  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru3  1  0.00000000  0.50000000  0.50000000  1.0