data_Sr5Tc4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.89
_cell_length_b   10.89
_cell_length_c   5.1
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr5Tc4
_chemical_formula_sum   'Sr10 Tc8'
_cell_volume   523.82
_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
  Sr  Sr0  1  0.01  0.94  0.82  1.0
  Sr  Sr1  1  0.88  0.0  0.82  1.0
  Sr  Sr2  1  0.56  0.5  0.82  1.0
  Sr  Sr3  1  0.44  0.5  0.27  1.0
  Sr  Sr4  1  0.01  0.0  0.27  1.0
  Sr  Sr5  1  0.99  0.94  0.27  1.0
  Sr  Sr6  1  0.0  0.29  0.55  1.0
  Sr  Sr7  1  0.45  0.15  0.0  1.0
  Sr  Sr8  1  0.45  0.15  0.55  1.0
  Sr  Sr9  1  0.0  0.29  0.0  1.0
  Tc  Tc10  1  0.0  0.0  0.55  1.0
  Tc  Tc11  1  0.0  0.0  0.0  1.0
  Tc  Tc12  1  0.57  0.44  0.82  1.0
  Tc  Tc13  1  0.76  0.0  0.82  1.0
  Tc  Tc14  1  0.12  0.99  0.82  1.0
  Tc  Tc15  1  0.88  0.99  0.27  1.0
  Tc  Tc16  1  0.13  0.0  0.27  1.0
  Tc  Tc17  1  0.43  0.44  0.27  1.0

data_Sr5Tc4
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.1
_cell_length_b   10.89
_cell_length_c   10.89
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr5Tc4
_chemical_formula_sum   'Sr10 Tc8'
_cell_volume   523.82
_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
  Sr  Sr0  1  -0.0  0.45  0.15  1.0
  Sr  Sr1  1  0.0  -0.0  0.29  1.0
  Sr  Sr2  1  0.27  0.01  0.0  1.0
  Sr  Sr3  1  0.27  0.44  0.5  1.0
  Sr  Sr4  1  0.27  0.99  0.94  1.0
  Sr  Sr5  1  0.55  -0.0  0.29  1.0
  Sr  Sr6  1  0.55  0.45  0.15  1.0
  Sr  Sr7  1  0.82  0.01  0.94  1.0
  Sr  Sr8  1  0.82  0.56  0.5  1.0
  Sr  Sr9  1  0.82  0.88  0.0  1.0
  Tc  Tc10  1  0.0  0.0  0.0  1.0
  Tc  Tc11  1  0.27  0.13  0.0  1.0
  Tc  Tc12  1  0.27  0.43  0.44  1.0
  Tc  Tc13  1  0.27  0.88  0.99  1.0
  Tc  Tc14  1  0.55  0.0  0.0  1.0
  Tc  Tc15  1  0.82  0.12  0.99  1.0
  Tc  Tc16  1  0.82  0.57  0.44  1.0
  Tc  Tc17  1  0.82  0.76  0.0  1.0

Sr Sr Sr Sr Sr Sr Sr Sr Sr Sr Tc Tc Tc Tc Tc Tc Tc Tc
Sr Sr Sr Sr Sr Sr Sr Sr Sr Sr Tc Tc Tc Tc Tc Tc Tc Tc 0 11 o + + 0 14 o o o 0 10 o + o 1 13 o o o 1 11 + o + 1 9 + o + 2 12 o o o 3 17 o o o 4 5 - - o 4 10 o o o 4 11 o o o 4 15 - - o 4 16 o o o 5 10 + + o 5 15 o o o 5 16 + + o 6 9 o o o 6 9 o o + 7 8 o o - 7 8 o o o 