data_ScZn2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18
_cell_length_b   4.57
_cell_length_c   5.85
_cell_angle_alpha   90.0
_cell_angle_beta   92.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScZn2Pb
_chemical_formula_sum   'Sc1 Zn2 Pb1'
_cell_volume   84.99
_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
  Sc  Sc1  1  0.0  0.0  0.0  1.0
  Zn  Zn2  1  0.59  0.28  0.23  1.0
  Zn  Zn3  1  0.33  0.28  0.62  1.0
  Pb  Pb0  1  0.46  0.0  0.92  1.0

data_ScZn2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   4.57
_cell_length_c   5.85
_cell_angle_alpha   90.0
_cell_angle_beta   92.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScZn2Pb
_chemical_formula_sum   'Sc1 Zn2 Pb1'
_cell_volume   84.99
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Zn  Zn1  1  0.33  0.28  0.62  1.0
  Zn  Zn2  1  0.59  0.28  0.23  1.0
  Pb  Pb3  1  0.46  0.0  0.92  1.0

Sc Zn Zn Pb