data_CrGa2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   5.28
_cell_angle_alpha   101.22
_cell_angle_beta   101.22
_cell_angle_gamma   34.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGa2Ag
_chemical_formula_sum   'Cr1 Ga2 Ag1'
_cell_volume   62.66
_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
  Ga  Ga2  1  0.28  0.0  0.16  1.0
  Ga  Ga3  1  0.41  0.0  0.01  1.0
  Ag  Ag0  1  0.85  0.0  0.59  1.0

data_CrGa2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   4.6
_cell_length_c   5.28
_cell_angle_alpha   101.22
_cell_angle_beta   90.0
_cell_angle_gamma   107.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGa2Ag
_chemical_formula_sum   'Cr1 Ga2 Ag1'
_cell_volume   62.66
_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
  Ga  Ga1  1  0.0  0.59  0.99  1.0
  Ga  Ga2  1  0.0  0.72  0.84  1.0
  Ag  Ag3  1  0.0  0.15  0.41  1.0

Cr Ga Ga Ag
Cr Ga Ga Ag 0 1 o o o 0 3 - o - 1 2 o o o 