[CIF]
data_ScTiNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02967160
_cell_length_b   4.26167835
_cell_length_c   4.64564431
_cell_angle_alpha   90.00000000
_cell_angle_beta   96.83087177
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTiNi2
_chemical_formula_sum   'Sc1 Ti1 Ni2'
_cell_volume   59.55639151
_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
  Ni  Ni0  1  2.06824243  0.00000000  4.30561981  1
  Ni  Ni1  1  2.58964281  2.13083918  1.39925490  1
  Sc  Sc2  1  1.11349319  0.00000000  1.85640088  1
  Ti  Ti3  1  0.42143019  2.13083918  3.97039314  1
[/CIF]
