[CIF]
data_CaLaB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.96009125
_cell_length_b   7.96009125
_cell_length_c   7.96009125
_cell_angle_alpha   24.36373755
_cell_angle_beta   24.36373755
_cell_angle_gamma   24.36373755
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaLaB2
_chemical_formula_sum   'Ca1 La1 B2'
_cell_volume   75.45409404
_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
  B  B0  1  0.00000000  -0.00000000  0.97901090  1
  B  B1  1  -0.00000000  -0.00000000  16.42367060  1
  Ca  Ca2  1  0.00000000  0.00000000  10.61963342  1
  La  La3  1  0.00000000  0.00000000  6.71849687  1
[/CIF]
