data_SrReTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   5.82
_cell_angle_alpha   104.08
_cell_angle_beta   104.08
_cell_angle_gamma   35.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrReTc2
_chemical_formula_sum   'Sr1 Re1 Tc2'
_cell_volume   83.72
_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  Sr1  1  0.83  0.0  0.38  1.0
  Re  Re0  1  0.24  0.0  0.45  1.0
  Tc  Tc2  1  0.92  0.0  0.05  1.0
  Tc  Tc3  1  0.28  0.0  0.18  1.0

data_SrReTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   5.04
_cell_length_c   5.82
_cell_angle_alpha   104.08
_cell_angle_beta   90.0
_cell_angle_gamma   107.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrReTc2
_chemical_formula_sum   'Sr1 Re1 Tc2'
_cell_volume   83.72
_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  0.17  0.62  1.0
  Tc  Tc1  1  0.0  0.08  0.95  1.0
  Tc  Tc2  1  0.0  0.72  0.82  1.0
  Re  Re3  1  0.0  0.76  0.55  1.0

Sr Re Tc Tc