data_YFeTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   4.76
_cell_angle_alpha   106.3
_cell_angle_beta   106.3
_cell_angle_gamma   33.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YFeTc2
_chemical_formula_sum   'Y1 Fe1 Tc2'
_cell_volume   65.49
_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
  Y  Y3  1  0.22  0.0  0.28  1.0
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.77  0.0  0.88  1.0
  Tc  Tc2  1  0.66  0.0  0.67  1.0

data_YFeTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.76
_cell_length_c   5.13
_cell_angle_alpha   106.3
_cell_angle_beta   106.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YFeTc2
_chemical_formula_sum   'Y1 Fe1 Tc2'
_cell_volume   65.49
_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
  Y  Y0  1  0.0  0.28  0.22  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.0  0.67  0.66  1.0
  Tc  Tc3  1  0.0  0.88  0.77  1.0

Y Fe Tc Tc