data_Zn2TcB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   3.45
_cell_length_c   4.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2TcB
_chemical_formula_sum   'Zn2 Tc1 B1'
_cell_volume   49.3
_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
  Zn  Zn2  1  0.6  0.0  0.24  1.0
  Zn  Zn3  1  0.0  0.72  0.24  1.0
  Tc  Tc1  1  0.6  0.72  0.0  1.0
  B  B0  1  0.0  0.0  0.0  1.0

data_Zn2TcB
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   3.45
_cell_length_c   4.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2TcB
_chemical_formula_sum   'Zn2 Tc1 B1'
_cell_volume   49.3
_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
  Zn  Zn0  1  -0.0  0.72  0.24  1.0
  Zn  Zn1  1  0.6  0.0  0.24  1.0
  Tc  Tc2  1  0.6  0.72  0.0  1.0
  B  B3  1  0.0  0.0  0.0  1.0

Zn Zn Tc B