data_Tc2BRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.78
_cell_length_b   4.78
_cell_length_c   4.78
_cell_angle_alpha   136.69
_cell_angle_beta   136.69
_cell_angle_gamma   62.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2BRu
_chemical_formula_sum   'Tc2 B1 Ru1'
_cell_volume   50.76
_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
  Tc  Tc2  1  0.0  0.76  0.04  1.0
  Tc  Tc3  1  0.76  0.0  0.04  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.0  0.0  0.08  1.0

data_Tc2BRu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.99
_cell_length_b   4.99
_cell_length_c   4.78
_cell_angle_alpha   90.0
_cell_angle_beta   121.46
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Tc2BRu
_chemical_formula_sum   'Tc4 B2 Ru2'
_cell_volume   101.51
_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
  Tc  Tc0  4  0.34  0.38  0.73  1.0
  B  B1  2  0.0  0.0  0.0  1.0
  Ru  Ru2  2  0.42  0.5  0.92  1.0

Tc Tc B Ru