data_[Sc4Al4V2Ni10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Al  1.6100  1.2500  0.6750
  V  1.6300  1.3500  0.7775
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.4315]
_cell_length_b [9.4315]
_cell_length_c [3.1840]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc2Al2VNi5]
_chemical_formula_sum '[Sc4 Al4 V2 Ni10]'
_cell_volume [283.2311]
_cell_formula_units_Z [2]
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  4  0.1726  0.3274  0.0000  1
  Al  Al1  4  0.1284  0.6284  0.0000  1
  V  V2  2  0.0000  0.0000  0.0000  1
  Ni  Ni3  8  0.0471  0.8072  0.5000  1
  Ni  Ni4  2  0.0000  0.5000  0.5000  1
]