data_Ti2AgW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.1
_cell_length_b   5.1
_cell_length_c   4.99
_cell_angle_alpha   98.05
_cell_angle_beta   98.05
_cell_angle_gamma   31.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2AgW
_chemical_formula_sum   'Ti2 Ag1 W1'
_cell_volume   67.8
_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  0.0  0.81  1.0
  Ti  Ti2  1  0.24  0.0  0.4  1.0
  Ag  Ag0  1  0.84  0.0  0.82  1.0
  W  W3  1  0.61  0.0  0.32  1.0

data_Ti2AgW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.8
_cell_length_b   4.99
_cell_length_c   5.1
_cell_angle_alpha   98.05
_cell_angle_beta   105.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2AgW
_chemical_formula_sum   'Ti2 Ag1 W1'
_cell_volume   67.8
_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  0.0  0.4  0.24  1.0
  Ti  Ti1  1  0.0  0.81  0.03  1.0
  Ag  Ag2  1  0.0  0.82  0.84  1.0
  W  W3  1  0.0  0.32  0.61  1.0

Ti Ti Ag W