data_NaLaCr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87
_cell_length_b   5.87
_cell_length_c   6.52
_cell_angle_alpha   123.41
_cell_angle_beta   123.41
_cell_angle_gamma   33.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLaCr2
_chemical_formula_sum   'Na1 La1 Cr2'
_cell_volume   100.46
_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  Na3  1  0.0  0.0  0.0  1.0
  La  La2  1  0.76  0.0  0.67  1.0
  Cr  Cr0  1  0.16  0.0  0.61  1.0
  Cr  Cr1  1  0.36  0.0  0.72  1.0

data_NaLaCr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.34
_cell_length_b   5.87
_cell_length_c   5.9
_cell_angle_alpha   67.21
_cell_angle_beta   73.54
_cell_angle_gamma   73.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLaCr2
_chemical_formula_sum   'Na1 La1 Cr2'
_cell_volume   100.46
_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  0.0  0.0  0.0  1.0
  La  La1  1  0.0  0.09  0.67  1.0
  Cr  Cr2  1  0.0  0.55  0.61  1.0
  Cr  Cr3  1  0.0  0.63  0.72  1.0

Na La Cr Cr