data_GaTc3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05
_cell_length_b   5.05
_cell_length_c   5.05
_cell_angle_alpha   116.77
_cell_angle_beta   116.77
_cell_angle_gamma   116.77
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTc3
_chemical_formula_sum   'Ga1 Tc3'
_cell_volume   58.75
_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
  Tc  Tc1  1  0.85  0.76  0.92  1.0
  Tc  Tc2  1  0.15  0.76  0.92  1.0
  Tc  Tc3  1  0.0  0.48  0.92  1.0

data_GaTc3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.75
_cell_length_b   5.05
_cell_length_c   5.05
_cell_angle_alpha   116.77
_cell_angle_beta   100.47
_cell_angle_gamma   100.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTc3
_chemical_formula_sum   'Ga1 Tc3'
_cell_volume   58.75
_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
  Tc  Tc1  1  0.92  0.92  0.44  1.0
  Tc  Tc2  1  0.92  0.07  0.16  1.0
  Tc  Tc3  1  0.92  0.77  0.16  1.0

Ga Tc Tc Tc