data_TcAsPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   3.24
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   102.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcAsPb2
_chemical_formula_sum   'Tc1 As1 Pb2'
_cell_volume   89.9
_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
  Tc  Tc3  1  0.34  0.0  0.0  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  Pb  Pb1  1  0.67  0.07  0.62  1.0
  Pb  Pb2  1  0.67  0.93  0.62  1.0

data_TcAsPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   102.24
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcAsPb2
_chemical_formula_sum   'Tc1 As1 Pb2'
_cell_volume   89.9
_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
  Tc  Tc0  1  -0.0  0.34  0.0  1.0
  As  As1  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.62  0.67  0.07  1.0
  Pb  Pb3  1  0.62  0.67  0.93  1.0

Tc As Pb Pb