[CIF]
data_ScNiF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.20995132
_cell_length_b   4.20995132
_cell_length_c   4.20995132
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNiF3
_chemical_formula_sum   'Sc1 Ni1 F3'
_cell_volume   74.61587260
_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  0.00000000  0.00000000  0.00000000  1
  Ni  Ni1  1  2.10497566  2.10497566  2.10497566  1
  F  F2  1  0.00000000  2.10497566  0.00000000  1
  F  F3  1  0.00000000  0.00000000  2.10497566  1
  F  F4  1  2.10497566  0.00000000  0.00000000  1
[/CIF]
