data_BaTc2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.2
_cell_length_b   5.2
_cell_length_c   5.99
_cell_angle_alpha   105.13
_cell_angle_beta   105.13
_cell_angle_gamma   43.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTc2Ag
_chemical_formula_sum   'Ba1 Tc2 Ag1'
_cell_volume   105.97
_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
  Ba  Ba1  1  0.99  0.0  0.87  1.0
  Tc  Tc2  1  0.11  0.0  0.21  1.0
  Tc  Tc3  1  0.88  0.0  0.54  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0

data_BaTc2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.81
_cell_length_b   5.2
_cell_length_c   5.99
_cell_angle_alpha   105.13
_cell_angle_beta   90.0
_cell_angle_gamma   111.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTc2Ag
_chemical_formula_sum   'Ba1 Tc2 Ag1'
_cell_volume   105.97
_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
  Ba  Ba0  1  0.0  0.01  0.13  1.0
  Tc  Tc1  1  0.0  0.12  0.46  1.0
  Tc  Tc2  1  0.0  0.89  0.79  1.0
  Ag  Ag3  1  0.0  0.0  0.0  1.0

Ba Tc Tc Ag
Ba Tc Tc Ag 0 3 + o + 0 2 o o o 1 3 o o o 
BaTc2Ag crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one BaTc2Ag cluster. Ba(1) is bonded in a distorted linear geometry to one Tc(2) and one Ag(1) atom. The Ba(1)-Tc(2) bond length is 1.92 Å. The Ba(1)-Ag(1) bond length is 0.75 Å. There are two inequivalent Tc sites. In the first Tc site, Tc(1) is bonded in a distorted single-bond geometry to one Ag(1) atom. The Tc(1)-Ag(1) bond length is 1.22 Å. In the second Tc site, Tc(2) is bonded in a single-bond geometry to one Ba(1) atom. Ag(1) is bonded in a distorted single-bond geometry to one Ba(1) and one Tc(1) atom.