data_SrSnB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84
_cell_length_b   3.84
_cell_length_c   7.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   130.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSnB2
_chemical_formula_sum   'Sr1 Sn1 B2'
_cell_volume   86.81
_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  0.52  1.0
  Sn  Sn2  1  0.61  0.0  0.46  1.0
  B  B0  1  0.61  0.0  0.78  1.0
  B  B1  1  0.0  0.0  0.55  1.0

data_SrSnB2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   3.84
_cell_length_c   7.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSnB2
_chemical_formula_sum   'Sr1 Sn1 B2'
_cell_volume   86.81
_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  0.0  0.52  1.0
  Sn  Sn1  1  0.0  0.61  0.46  1.0
  B  B2  1  0.0  0.0  0.55  1.0
  B  B3  1  0.0  0.61  0.78  1.0

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