data_GaTcBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93
_cell_length_b   4.93
_cell_length_c   7.1
_cell_angle_alpha   108.32
_cell_angle_beta   108.32
_cell_angle_gamma   39.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTcBr2
_chemical_formula_sum   'Ga1 Tc1 Br2'
_cell_volume   102.94
_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  0.88  0.0  0.19  1.0
  Tc  Tc3  1  0.3  0.0  0.18  1.0
  Br  Br0  1  0.13  0.0  0.14  1.0
  Br  Br1  1  0.02  0.0  0.21  1.0

data_GaTcBr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   4.93
_cell_length_c   7.1
_cell_angle_alpha   108.32
_cell_angle_beta   90.0
_cell_angle_gamma   109.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTcBr2
_chemical_formula_sum   'Ga1 Tc1 Br2'
_cell_volume   102.94
_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  0.12  0.81  1.0
  Tc  Tc1  1  0.0  0.7  0.82  1.0
  Br  Br2  1  0.0  0.87  0.86  1.0
  Br  Br3  1  0.0  0.98  0.79  1.0

Ga Tc Br Br