data_Ti2MoW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79
_cell_length_b   4.52
_cell_length_c   5.24
_cell_angle_alpha   90.0
_cell_angle_beta   101.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2MoW
_chemical_formula_sum   'Ti2 Mo1 W1'
_cell_volume   64.68
_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  Ti1  1  0.03  0.26  0.12  1.0
  Ti  Ti2  1  0.78  0.0  0.29  1.0
  Mo  Mo0  1  0.95  0.0  0.82  1.0
  W  W3  1  0.79  0.26  0.6  1.0

data_Ti2MoW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.52
_cell_length_c   5.24
_cell_angle_alpha   90.0
_cell_angle_beta   101.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2MoW
_chemical_formula_sum   'Ti2 Mo1 W1'
_cell_volume   64.68
_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  0.03  0.26  0.12  1.0
  Ti  Ti1  1  0.78  0.0  0.29  1.0
  Mo  Mo2  1  0.95  0.0  0.82  1.0
  W  W3  1  0.79  0.26  0.6  1.0

Ti Ti Mo W
Ti Ti Mo W 0 2 - o - 0 1 - o o 1 3 o o o 2 3 o o o 