data_FeTcSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.0
_cell_length_b   5.0
_cell_length_c   4.54
_cell_angle_alpha   100.93
_cell_angle_beta   100.93
_cell_angle_gamma   38.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeTcSb2
_chemical_formula_sum   'Fe1 Tc1 Sb2'
_cell_volume   68.63
_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
  Fe  Fe0  1  0.76  0.0  0.74  1.0
  Tc  Tc3  1  0.18  0.0  0.87  1.0
  Sb  Sb1  1  0.58  0.0  0.09  1.0
  Sb  Sb2  1  0.82  0.0  0.42  1.0

data_FeTcSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   4.54
_cell_length_c   5.0
_cell_angle_alpha   100.93
_cell_angle_beta   109.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeTcSb2
_chemical_formula_sum   'Fe1 Tc1 Sb2'
_cell_volume   68.63
_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
  Fe  Fe0  1  0.0  0.74  0.76  1.0
  Tc  Tc1  1  0.0  0.87  0.18  1.0
  Sb  Sb2  1  0.0  0.09  0.58  1.0
  Sb  Sb3  1  0.0  0.42  0.82  1.0

Fe Tc Sb Sb