[CIF]
data_ZrScCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57350006
_cell_length_b   5.57350006
_cell_length_c   5.57350006
_cell_angle_alpha   147.52436158
_cell_angle_beta   114.25904555
_cell_angle_gamma   75.25707014
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScCl2
_chemical_formula_sum   'Zr1 Sc1 Cl2'
_cell_volume   83.23968475
_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
  Cl  Cl0  1  1.55848943  -0.00000000  2.22525471  1
  Cl  Cl1  1  0.00000000  3.02497116  2.18887749  1
  Sc  Sc2  1  -0.00000000  0.00000000  0.00000000  1
  Zr  Zr3  1  -0.00000000  0.00000000  4.41413220  1
[/CIF]
