data_NbTc2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26
_cell_length_b   5.26
_cell_length_c   5.26
_cell_angle_alpha   145.01
_cell_angle_beta   129.95
_cell_angle_gamma   62.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTc2Mo
_chemical_formula_sum   'Nb1 Tc2 Mo1'
_cell_volume   63.15
_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  0.0  0.0  0.23  1.0
  Tc  Tc2  1  0.58  0.0  0.46  1.0
  Tc  Tc3  1  0.0  0.0  0.78  1.0
  Mo  Mo0  1  0.58  0.0  0.01  1.0

data_NbTc2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.16
_cell_length_b   4.45
_cell_length_c   5.26
_cell_angle_alpha   115.02
_cell_angle_beta   107.49
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbTc2Mo
_chemical_formula_sum   'Nb1 Tc2 Mo1'
_cell_volume   63.15
_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  0.77  0.77  0.77  1.0
  Tc  Tc1  1  0.12  0.54  0.12  1.0
  Tc  Tc2  1  0.22  0.22  0.22  1.0
  Mo  Mo3  1  0.57  0.99  0.57  1.0

Nb Tc Tc Mo