data_ScNbSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.7
_cell_length_b   5.7
_cell_length_c   5.11
_cell_angle_alpha   96.51
_cell_angle_beta   96.51
_cell_angle_gamma   31.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNbSn2
_chemical_formula_sum   'Sc1 Nb1 Sn2'
_cell_volume   87.1
_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  Sc1  1  0.22  0.0  0.91  1.0
  Nb  Nb0  1  0.22  0.0  0.42  1.0
  Sn  Sn2  1  0.29  0.0  0.91  1.0
  Sn  Sn3  1  0.17  0.0  0.45  1.0

data_ScNbSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   5.11
_cell_length_c   5.7
_cell_angle_alpha   96.51
_cell_angle_beta   105.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNbSn2
_chemical_formula_sum   'Sc1 Nb1 Sn2'
_cell_volume   87.1
_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  0.0  0.91  0.22  1.0
  Nb  Nb1  1  0.0  0.42  0.22  1.0
  Sn  Sn2  1  0.0  0.45  0.17  1.0
  Sn  Sn3  1  0.0  0.91  0.29  1.0

Sc Nb Sn Sn