data_Nb2TcAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93
_cell_length_b   4.93
_cell_length_c   4.95
_cell_angle_alpha   98.12
_cell_angle_beta   98.12
_cell_angle_gamma   35.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2TcAu
_chemical_formula_sum   'Nb2 Tc1 Au1'
_cell_volume   68.62
_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  Nb1  1  0.73  0.0  0.7  1.0
  Nb  Nb2  1  0.92  0.0  0.2  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.33  0.0  0.45  1.0

data_Nb2TcAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   4.93
_cell_length_c   4.95
_cell_angle_alpha   98.12
_cell_angle_beta   90.0
_cell_angle_gamma   107.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2TcAu
_chemical_formula_sum   'Nb2 Tc1 Au1'
_cell_volume   68.62
_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  0.08  0.8  1.0
  Nb  Nb1  1  0.0  0.27  0.3  1.0
  Tc  Tc2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.67  0.55  1.0

Nb Nb Tc Au