data_Tc2NiMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.61
_cell_length_b   4.33
_cell_length_c   5.08
_cell_angle_alpha   90.0
_cell_angle_beta   98.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2NiMo
_chemical_formula_sum   'Tc2 Ni1 Mo1'
_cell_volume   56.73
_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
  Tc  Tc2  1  0.7  0.16  0.2  1.0
  Tc  Tc3  1  0.12  0.16  0.82  1.0
  Ni  Ni1  1  0.0  0.0  0.0  1.0
  Mo  Mo0  1  0.91  0.0  0.51  1.0

data_Tc2NiMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.61
_cell_length_b   4.33
_cell_length_c   5.08
_cell_angle_alpha   90.0
_cell_angle_beta   98.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2NiMo
_chemical_formula_sum   'Tc2 Ni1 Mo1'
_cell_volume   56.73
_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
  Tc  Tc0  1  0.12  0.16  0.82  1.0
  Tc  Tc1  1  0.7  0.16  0.2  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Mo  Mo3  1  0.91  0.0  0.51  1.0

Tc Tc Ni Mo