data_MnTc8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.1
_cell_length_b   6.1
_cell_length_c   6.1
_cell_angle_alpha   95.72
_cell_angle_beta   95.72
_cell_angle_gamma   143.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnTc8
_chemical_formula_sum   'Mn1 Tc8'
_cell_volume   128.7
_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
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.34  0.66  0.92  1.0
  Tc  Tc2  1  0.66  0.34  0.92  1.0
  Tc  Tc3  1  0.0  0.48  0.0  1.0
  Tc  Tc4  1  0.75  0.75  0.0  1.0
  Tc  Tc5  1  0.48  0.0  0.0  1.0
  Tc  Tc6  1  0.34  0.34  0.92  1.0
  Tc  Tc7  1  0.0  0.69  0.0  1.0
  Tc  Tc8  1  0.69  0.0  0.0  1.0

data_MnTc8
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.85
_cell_length_b   11.57
_cell_length_c   6.1
_cell_angle_alpha   90.0
_cell_angle_beta   108.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnTc8
_chemical_formula_sum   'Mn2 Tc16'
_cell_volume   257.39
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Mn  Mn0  2  0.0  0.0  0.0  1.0
  Tc  Tc1  4  -0.0  0.34  0.08  1.0
  Tc  Tc2  4  0.15  0.15  0.0  1.0
  Tc  Tc3  4  0.26  0.26  0.0  1.0
  Tc  Tc4  2  0.16  0.5  0.08  1.0
  Tc  Tc5  2  0.25  0.0  -0.0  1.0

Mn Tc Tc Tc Tc Tc Tc Tc Tc