data_BaTc2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.06
_cell_length_b   7.06
_cell_length_c   7.06
_cell_angle_alpha   35.63
_cell_angle_beta   35.63
_cell_angle_gamma   35.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTc2Sn
_chemical_formula_sum   'Ba1 Tc2 Sn1'
_cell_volume   106.67
_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
  Ba  Ba0  1  0.0  0.0  0.72  1.0
  Tc  Tc2  1  0.0  0.0  0.3  1.0
  Tc  Tc3  1  0.0  0.0  0.87  1.0
  Sn  Sn1  1  0.0  0.0  0.71  1.0

data_BaTc2Sn
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.48
_cell_length_b   4.32
_cell_length_c   7.06
_cell_angle_alpha   90.0
_cell_angle_beta   110.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BaTc2Sn
_chemical_formula_sum   'Ba2 Tc4 Sn2'
_cell_volume   213.34
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ba  Ba0  2  -0.0  0.0  0.28  1.0
  Tc  Tc1  2  -0.0  0.0  0.7  1.0
  Tc  Tc2  2  -0.0  0.0  0.13  1.0
  Sn  Sn3  2  -0.0  0.0  0.29  1.0

Ba Tc Tc Sn