data_TiNbMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37
_cell_length_b   5.37
_cell_length_c   5.37
_cell_angle_alpha   145.38
_cell_angle_beta   130.51
_cell_angle_gamma   61.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNbMo2
_chemical_formula_sum   'Ti1 Nb1 Mo2'
_cell_volume   66.06
_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
  Ti  Ti3  1  0.0  0.0  0.95  1.0
  Nb  Nb2  1  0.6  0.0  0.53  1.0
  Mo  Mo0  1  0.6  0.0  0.08  1.0
  Mo  Mo1  1  0.0  0.0  0.25  1.0

data_TiNbMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.19
_cell_length_b   4.49
_cell_length_c   5.37
_cell_angle_alpha   114.74
_cell_angle_beta   107.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNbMo2
_chemical_formula_sum   'Ti1 Nb1 Mo2'
_cell_volume   66.06
_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
  Ti  Ti0  1  0.05  0.05  0.05  1.0
  Nb  Nb1  1  0.07  0.47  0.07  1.0
  Mo  Mo2  1  0.52  0.92  0.52  1.0
  Mo  Mo3  1  0.75  0.75  0.75  1.0

Ti Nb Mo Mo