data_ScNiAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99
_cell_length_b   4.99
_cell_length_c   4.99
_cell_angle_alpha   133.01
_cell_angle_beta   131.59
_cell_angle_gamma   69.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNiAg2
_chemical_formula_sum   'Sc1 Ni1 Ag2'
_cell_volume   66.47
_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  0.0  0.0  0.1  1.0
  Ni  Ni2  1  0.0  0.04  0.02  1.0
  Ag  Ag0  1  0.0  0.04  0.09  1.0
  Ag  Ag1  1  0.0  0.0  0.06  1.0

data_ScNiAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.98
_cell_length_b   4.09
_cell_length_c   4.99
_cell_angle_alpha   114.21
_cell_angle_beta   113.49
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNiAg2
_chemical_formula_sum   'Sc1 Ni1 Ag2'
_cell_volume   66.47
_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  0.9  0.9  0.9  1.0
  Ni  Ni1  1  0.98  0.02  0.02  1.0
  Ag  Ag2  1  0.91  0.96  0.96  1.0
  Ag  Ag3  1  0.94  0.94  0.94  1.0

Sc Ni Ag Ag