[CIF]
data_Na2ZrSc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66482506
_cell_length_b   5.66482506
_cell_length_c   6.58987068
_cell_angle_alpha   96.04159241
_cell_angle_beta   96.04159241
_cell_angle_gamma   31.28860057
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2ZrSc
_chemical_formula_sum   'Na2 Zr1 Sc1'
_cell_volume   109.16905245
_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
  Na  Na0  1  -0.69179471  0.00000000  6.50930985  1
  Na  Na1  1  2.17879084  -0.00000000  4.97649588  1
  Sc  Sc2  1  5.01198843  -0.00000000  2.96754567  1
  Zr  Zr3  1  8.06524607  -0.00000000  1.92262335  1
[/CIF]
