data_TiVW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.7
_cell_length_b   4.7
_cell_length_c   4.7
_cell_angle_alpha   147.43
_cell_angle_beta   121.69
_cell_angle_gamma   68.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiVW
_chemical_formula_sum   'Ti1 V1 W1'
_cell_volume   46.86
_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  0.0  0.0  1.0
  V  V1  1  0.0  0.0  0.16  1.0
  W  W2  1  0.0  0.0  0.61  1.0

data_TiVW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.63
_cell_length_b   4.58
_cell_length_c   4.7
_cell_angle_alpha   119.16
_cell_angle_beta   106.28
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiVW
_chemical_formula_sum   'Ti1 V1 W1'
_cell_volume   46.86
_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  0.0  0.0  1.0
  V  V1  1  0.0  0.16  0.16  1.0
  W  W2  1  0.0  0.61  0.61  1.0

Ti V W
Ti V W 0 1 o o o 0 2 o o - 1 2 o o o 