data_ScCrAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17
_cell_length_b   3.9
_cell_length_c   5.93
_cell_angle_alpha   90.0
_cell_angle_beta   92.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCrAg2
_chemical_formula_sum   'Sc1 Cr1 Ag2'
_cell_volume   73.42
_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  Sc3  1  0.34  0.0  0.43  1.0
  Cr  Cr2  1  0.02  0.95  0.9  1.0
  Ag  Ag0  1  0.0  0.95  0.02  1.0
  Ag  Ag1  1  0.52  0.0  0.53  1.0

data_ScCrAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   3.9
_cell_length_c   5.93
_cell_angle_alpha   90.0
_cell_angle_beta   92.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCrAg2
_chemical_formula_sum   'Sc1 Cr1 Ag2'
_cell_volume   73.42
_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  0.34  0.0  0.43  1.0
  Cr  Cr1  1  0.02  0.95  0.9  1.0
  Ag  Ag2  1  0.0  0.95  0.02  1.0
  Ag  Ag3  1  0.52  0.0  0.53  1.0

Sc Cr Ag Ag