data_CrAgGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   5.22
_cell_angle_alpha   136.2
_cell_angle_beta   136.2
_cell_angle_gamma   63.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrAgGe2
_chemical_formula_sum   'Cr1 Ag1 Ge2'
_cell_volume   67.07
_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  Cr1  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.95  0.22  1.0
  Ge  Ge2  1  0.95  0.0  0.22  1.0
  Ge  Ge3  1  0.0  0.0  0.43  1.0

data_CrAgGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.89
_cell_length_b   3.89
_cell_length_c   5.22
_cell_angle_alpha   111.9
_cell_angle_beta   111.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrAgGe2
_chemical_formula_sum   'Cr1 Ag1 Ge2'
_cell_volume   67.07
_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
  Ag  Ag1  1  0.73  0.95  0.73  1.0
  Ge  Ge2  1  0.57  0.0  0.57  1.0
  Ge  Ge3  1  0.78  0.0  0.73  1.0

Cr Ag Ge Ge
Cr Ag Ge Ge 0 2 - o o 0 1 o - o 1 2 - + o 1 3 o + o 2 3 + o o 