data_SrCdB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69
_cell_length_b   6.69
_cell_length_c   6.69
_cell_angle_alpha   152.56
_cell_angle_beta   145.89
_cell_angle_gamma   44.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCdB2
_chemical_formula_sum   'Sr1 Cd1 B2'
_cell_volume   77.07
_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
  Sr  Sr3  1  0.0  0.0  0.51  1.0
  Cd  Cd2  1  0.59  0.0  0.13  1.0
  B  B0  1  0.59  0.0  0.34  1.0
  B  B1  1  0.0  0.0  0.59  1.0

data_SrCdB2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   3.92
_cell_length_c   6.69
_cell_angle_alpha   107.05
_cell_angle_beta   103.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCdB2
_chemical_formula_sum   'Sr1 Cd1 B2'
_cell_volume   77.07
_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
  Sr  Sr0  1  0.0  0.51  0.51  1.0
  Cd  Cd1  1  0.0  0.13  0.55  1.0
  B  B2  1  0.0  0.34  0.76  1.0
  B  B3  1  0.0  0.59  0.59  1.0

Sr Cd B B
Sr Cd B B 0 3 o o o 0 1 - o o 1 2 o o o 2 3 + o o 