[CIF]
data_Ba2NbMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.55837457
_cell_length_b   3.55837457
_cell_length_c   10.25469867
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2NbMo
_chemical_formula_sum   'Ba2 Nb1 Mo1'
_cell_volume   129.84529816
_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
  Ba  Ba0  1  1.77918729  1.77918729  9.55478011  1
  Ba  Ba1  1  0.00000000  0.00000000  3.33611446  1
  Mo  Mo2  1  1.77918729  1.77918729  5.87050304  1
  Nb  Nb3  1  0.00000000  0.00000000  6.87534907  1
[/CIF]
