data_ZrTc2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.6
_cell_length_b   5.6
_cell_length_c   5.6
_cell_angle_alpha   145.18
_cell_angle_beta   132.47
_cell_angle_gamma   60.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTc2Pb
_chemical_formula_sum   'Zr1 Tc2 Pb1'
_cell_volume   73.08
_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
  Zr  Zr3  1  0.0  0.0  0.91  1.0
  Tc  Tc1  1  0.0  0.0  0.59  1.0
  Tc  Tc2  1  0.0  0.25  0.55  1.0
  Pb  Pb0  1  0.67  0.0  0.3  1.0

data_ZrTc2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.51
_cell_length_c   5.6
_cell_angle_alpha   113.76
_cell_angle_beta   107.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTc2Pb
_chemical_formula_sum   'Zr1 Tc2 Pb1'
_cell_volume   73.08
_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
  Zr  Zr0  1  0.09  0.09  0.09  1.0
  Tc  Tc1  1  0.41  0.41  0.41  1.0
  Tc  Tc2  1  0.45  0.7  0.7  1.0
  Pb  Pb3  1  0.37  0.7  0.37  1.0

Zr Tc Tc Pb