data_TiCrTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.7
_cell_length_b   4.2
_cell_length_c   5.05
_cell_angle_alpha   90.0
_cell_angle_beta   99.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCrTc2
_chemical_formula_sum   'Ti1 Cr1 Tc2'
_cell_volume   56.63
_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  Ti3  1  0.0  0.0  0.0  1.0
  Cr  Cr0  1  0.96  0.0  0.49  1.0
  Tc  Tc1  1  0.11  0.1  0.72  1.0
  Tc  Tc2  1  0.8  0.1  0.26  1.0

data_TiCrTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   4.2
_cell_length_c   5.05
_cell_angle_alpha   90.0
_cell_angle_beta   99.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCrTc2
_chemical_formula_sum   'Ti1 Cr1 Tc2'
_cell_volume   56.63
_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
  Cr  Cr1  1  0.96  0.0  0.49  1.0
  Tc  Tc2  1  0.11  0.1  0.72  1.0
  Tc  Tc3  1  0.8  0.1  0.26  1.0

Ti Cr Tc Tc