data_CsTcO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.27
_cell_length_b   7.27
_cell_length_c   7.27
_cell_angle_alpha   44.25
_cell_angle_beta   44.25
_cell_angle_gamma   44.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsTcO3
_chemical_formula_sum   'Cs2 Tc2 O6'
_cell_volume   170.18
_cell_formula_units_Z   2
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
  Cs  Cs0  1  0.0  0.0  0.23  1.0
  Cs  Cs1  1  0.0  0.0  0.42  1.0
  Tc  Tc8  1  0.0  0.0  0.09  1.0
  Tc  Tc9  1  0.0  0.0  0.55  1.0
  O  O2  1  0.0  0.42  0.93  1.0
  O  O3  1  0.63  0.79  0.93  1.0
  O  O4  1  0.37  0.79  0.93  1.0
  O  O5  1  0.63  0.21  0.72  1.0
  O  O6  1  0.37  0.21  0.72  1.0
  O  O7  1  0.0  0.58  0.72  1.0

data_CsTcO3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   5.48
_cell_length_b   5.48
_cell_length_c   7.27
_cell_angle_alpha   67.87
_cell_angle_beta   67.87
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   CsTcO3
_chemical_formula_sum   'Cs2 Tc2 O6'
_cell_volume   170.18
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Cs  Cs0  2  0.0  0.4  0.1  1.0
  Tc  Tc1  2  0.0  0.27  0.23  1.0
  O  O2  2  0.21  0.9  0.02  1.0
  O  O3  2  0.21  0.9  0.77  1.0
  O  O4  2  0.42  0.1  0.98  1.0

Cs Cs Tc Tc O O O O O O