data_Sn2B
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.9
_cell_length_b   5.6
_cell_length_c   2.46
_cell_angle_alpha   84.39
_cell_angle_beta   71.07
_cell_angle_gamma   24.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2B
_chemical_formula_sum   'Sn2 B1'
_cell_volume   27.6
_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
  Sn  Sn1  1  0.16  0.17  0.89  1.0
  Sn  Sn2  1  0.16  0.17  0.08  1.0
  B  B0  1  0.0  0.0  0.0  1.0

data_Sn2B
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.32
_cell_length_b   2.46
_cell_length_c   5.6
_cell_angle_alpha   84.39
_cell_angle_beta   78.05
_cell_angle_gamma   61.85
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2B
_chemical_formula_sum   'Sn2 B1'
_cell_volume   27.6
_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
  Sn  Sn0  1  0.22  0.95  0.67  1.0
  Sn  Sn1  1  0.41  0.76  0.67  1.0
  B  B2  1  0.0  0.0  0.0  1.0

Sn Sn B