data_Sc(VAg)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34
_cell_length_b   6.34
_cell_length_c   6.34
_cell_angle_alpha   142.68
_cell_angle_beta   142.68
_cell_angle_gamma   53.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc(VAg)2
_chemical_formula_sum   'Sc1 V2 Ag2'
_cell_volume   93.01
_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  Sc2  1  0.0  0.0  0.0  1.0
  V  V3  1  0.0  0.0  0.58  1.0
  V  V4  1  0.0  0.0  0.73  1.0
  Ag  Ag0  1  0.0  0.03  0.83  1.0
  Ag  Ag1  1  0.03  0.0  0.83  1.0

data_Sc(VAg)2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.74
_cell_length_b   5.74
_cell_length_c   6.34
_cell_angle_alpha   90.0
_cell_angle_beta   116.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Sc(VAg)2
_chemical_formula_sum   'Sc2 V4 Ag4'
_cell_volume   186.03
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  V  V1  2  0.0  0.0  0.27  1.0
  V  V2  2  0.0  0.0  0.42  1.0
  Ag  Ag3  4  0.01  0.01  0.2  1.0

Sc V V Ag Ag
Sc V V Ag Ag 0 3 o o - 0 4 o o - 1 2 o o o 2 3 o o o 2 4 o o o 3 4 o o o 