data_Ga2TcB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04
_cell_length_b   7.04
_cell_length_c   7.04
_cell_angle_alpha   25.35
_cell_angle_beta   25.35
_cell_angle_gamma   25.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2TcB
_chemical_formula_sum   'Ga2 Tc1 B1'
_cell_volume   56.36
_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  Ga1  1  0.0  0.0  0.95  1.0
  Ga  Ga2  1  0.0  0.0  0.45  1.0
  Tc  Tc3  1  0.0  0.0  0.67  1.0
  B  B0  1  0.0  0.0  0.02  1.0

data_Ga2TcB
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.35
_cell_length_b   3.09
_cell_length_c   7.04
_cell_angle_alpha   90.0
_cell_angle_beta   104.68
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Ga2TcB
_chemical_formula_sum   'Ga4 Tc2 B2'
_cell_volume   112.73
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.05  1.0
  Ga  Ga1  2  0.0  0.0  0.55  1.0
  Tc  Tc2  2  0.0  0.0  0.33  1.0
  B  B3  2  0.0  0.0  0.98  1.0

Ga Ga Tc B