data_LiTc2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   4.93
_cell_angle_alpha   97.9
_cell_angle_beta   97.9
_cell_angle_gamma   38.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTc2Sb
_chemical_formula_sum   'Li1 Tc2 Sb1'
_cell_volume   63.85
_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
  Li  Li0  1  0.96  0.0  0.42  1.0
  Tc  Tc2  1  0.3  0.0  0.74  1.0
  Tc  Tc3  1  0.66  0.0  0.73  1.0
  Sb  Sb1  1  0.26  0.0  0.3  1.0

data_LiTc2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   4.58
_cell_length_c   4.93
_cell_angle_alpha   97.9
_cell_angle_beta   90.0
_cell_angle_gamma   109.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTc2Sb
_chemical_formula_sum   'Li1 Tc2 Sb1'
_cell_volume   63.85
_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
  Li  Li0  1  0.0  0.04  0.58  1.0
  Tc  Tc1  1  0.0  0.34  0.27  1.0
  Tc  Tc2  1  0.0  0.7  0.26  1.0
  Sb  Sb3  1  0.0  0.74  0.7  1.0

Li Tc Tc Sb