data_CrFePb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44
_cell_length_b   3.7
_cell_length_c   6.74
_cell_angle_alpha   90.0
_cell_angle_beta   98.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFePb2
_chemical_formula_sum   'Cr1 Fe1 Pb2'
_cell_volume   84.98
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.51  0.0  0.33  1.0
  Pb  Pb2  1  0.93  0.85  0.94  1.0
  Pb  Pb3  1  0.53  0.85  0.73  1.0

data_CrFePb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.44
_cell_length_b   3.7
_cell_length_c   6.74
_cell_angle_alpha   90.0
_cell_angle_beta   98.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFePb2
_chemical_formula_sum   'Cr1 Fe1 Pb2'
_cell_volume   84.98
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.51  0.0  0.33  1.0
  Pb  Pb2  1  0.53  0.85  0.73  1.0
  Pb  Pb3  1  0.93  0.85  0.94  1.0

Cr Fe Pb Pb
Cr Fe Pb Pb 0 2 - - - 0 1 o o o 0 1 - o o 1 2 - - - 1 2 o - - 1 3 o - o 2 3 o o o 