data_TiNi2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64
_cell_length_b   4.64
_cell_length_c   4.64
_cell_angle_alpha   133.94
_cell_angle_beta   130.59
_cell_angle_gamma   69.85
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNi2W
_chemical_formula_sum   'Ti1 Ni2 W1'
_cell_volume   53.41
_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  Ti2  1  0.0  0.0  0.0  1.0
  Ni  Ni0  1  0.0  0.94  0.89  1.0
  Ni  Ni1  1  0.81  0.0  0.91  1.0
  W  W3  1  0.0  0.0  0.8  1.0

data_TiNi2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   3.87
_cell_length_c   4.64
_cell_angle_alpha   114.71
_cell_angle_beta   113.03
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNi2W
_chemical_formula_sum   'Ti1 Ni2 W1'
_cell_volume   53.41
_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
  Ni  Ni1  1  0.11  0.04  0.04  1.0
  Ni  Ni2  1  0.91  0.09  0.91  1.0
  W  W3  1  0.2  0.2  0.2  1.0

Ti Ni Ni W