data_ScVSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.56
_cell_length_b   5.56
_cell_length_c   5.56
_cell_angle_alpha   136.35
_cell_angle_beta   136.35
_cell_angle_gamma   63.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScVSn2
_chemical_formula_sum   'Sc1 V1 Sn2'
_cell_volume   80.9
_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  0.0  0.0  1.0
  V  V3  1  0.0  0.07  0.37  1.0
  Sn  Sn1  1  0.07  0.0  0.37  1.0
  Sn  Sn2  1  0.0  0.0  0.73  1.0

data_ScVSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.14
_cell_length_b   4.14
_cell_length_c   5.56
_cell_angle_alpha   111.82
_cell_angle_beta   111.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScVSn2
_chemical_formula_sum   'Sc1 V1 Sn2'
_cell_volume   80.9
_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  0.0  0.0  1.0
  V  V1  1  0.3  0.37  0.3  1.0
  Sn  Sn2  1  0.37  0.3  0.3  1.0
  Sn  Sn3  1  0.73  0.73  0.73  1.0

Sc V Sn Sn