data_GaSnB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.38
_cell_length_b   3.37
_cell_length_c   5.6
_cell_angle_alpha   90.0
_cell_angle_beta   106.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaSnB2
_chemical_formula_sum   'Ga1 Sn1 B2'
_cell_volume   61.14
_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
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.88  0.0  0.68  1.0
  B  B0  1  0.58  0.69  0.61  1.0
  B  B1  1  0.18  0.69  0.76  1.0

data_GaSnB2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   3.38
_cell_length_c   5.6
_cell_angle_alpha   106.83
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaSnB2
_chemical_formula_sum   'Ga1 Sn1 B2'
_cell_volume   61.14
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.0  0.12  0.32  1.0
  B  B2  1  0.31  0.42  0.39  1.0
  B  B3  1  0.31  0.82  0.24  1.0

Ga Sn B B