data_Ni2GePb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64
_cell_length_b   5.99
_cell_length_c   5.99
_cell_angle_alpha   31.31
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2GePb
_chemical_formula_sum   'Ni2 Ge1 Pb1'
_cell_volume   67.88
_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
  Ni  Ni1  1  0.82  0.0  0.68  1.0
  Ni  Ni2  1  0.0  0.0  0.46  1.0
  Ge  Ge0  1  0.0  0.0  0.43  1.0
  Pb  Pb3  1  0.82  0.0  0.5  1.0

data_Ni2GePb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   3.64
_cell_length_c   5.99
_cell_angle_alpha   90.0
_cell_angle_beta   105.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni2GePb
_chemical_formula_sum   'Ni2 Ge1 Pb1'
_cell_volume   67.88
_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
  Ni  Ni0  1  0.32  0.82  0.32  1.0
  Ni  Ni1  1  0.54  0.0  0.54  1.0
  Ge  Ge2  1  0.57  0.0  0.57  1.0
  Pb  Pb3  1  0.5  0.82  0.5  1.0

Ni Ni Ge Pb
Ni Ni Ge Pb 0 3 o o o 1 2 o o o 1 3 - o o 2 3 - o o 