data_NbTcW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31
_cell_length_b   5.31
_cell_length_c   5.31
_cell_angle_alpha   145.15
_cell_angle_beta   130.02
_cell_angle_gamma   62.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTcW2
_chemical_formula_sum   'Nb1 Tc1 W2'
_cell_volume   64.96
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.0  0.0  0.55  1.0
  W  W2  1  0.59  0.0  0.28  1.0
  W  W3  1  0.0  0.24  0.26  1.0

data_NbTcW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   4.49
_cell_length_c   5.31
_cell_angle_alpha   114.99
_cell_angle_beta   107.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTcW2
_chemical_formula_sum   'Nb1 Tc1 W2'
_cell_volume   64.96
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.45  0.45  0.45  1.0
  W  W2  1  0.31  0.72  0.31  1.0
  W  W3  1  0.74  0.98  0.98  1.0

Nb Tc W W