data_AlV2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.0
_cell_length_b   5.0
_cell_length_c   5.0
_cell_angle_alpha   138.54
_cell_angle_beta   128.83
_cell_angle_gamma   67.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlV2Sn
_chemical_formula_sum   'Al1 V2 Sn1'
_cell_volume   63.49
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  V  V2  1  0.77  0.0  0.03  1.0
  V  V3  1  0.0  0.16  0.12  1.0
  Sn  Sn1  1  0.0  0.0  0.15  1.0

data_AlV2Sn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.32
_cell_length_c   5.0
_cell_angle_alpha   115.58
_cell_angle_beta   110.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlV2Sn
_chemical_formula_sum   'Al1 V2 Sn1'
_cell_volume   63.49
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  V  V1  1  0.74  0.97  0.74  1.0
  V  V2  1  0.88  0.04  0.04  1.0
  Sn  Sn3  1  0.85  0.85  0.85  1.0

Al V V Sn