data_InTc2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.87
_cell_length_b   4.8
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InTc2Cl
_chemical_formula_sum   'In1 Tc2 Cl1'
_cell_volume   68.88
_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
  In  In1  1  0.44  0.0  0.5  1.0
  Tc  Tc2  1  0.44  0.4  0.0  1.0
  Tc  Tc3  1  0.0  0.4  0.5  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_InTc2Cl
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.87
_cell_length_b   5.0
_cell_length_c   4.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   InTc2Cl
_chemical_formula_sum   'In1 Tc2 Cl1'
_cell_volume   68.88
_cell_formula_units_Z   1
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
  In  In0  1  0.44  0.5  0.0  1.0
  Tc  Tc1  1  0.0  0.5  0.4  1.0
  Tc  Tc2  1  0.44  0.0  0.4  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

In Tc Tc Cl
In Tc Tc Cl 0 3 o o o 0 3 o o + 0 3 + o o 0 3 + o + 0 2 o o o 0 2 + o o 0 0 + o o 0 1 o o o 1 3 o o o 1 3 + o o 1 2 o o - 1 2 o o o 1 2 + o - 1 2 + o o 1 1 + o o 2 2 + o o 2 3 o o o 3 3 + o o 
Tc2InCl crystallizes in the triclinic P1 space group. There are two inequivalent Tc sites. In the first Tc site, Tc(1) is bonded in a 2-coordinate geometry to three equivalent Cl(1) atoms. There are a spread of Tc(1)-Cl(1) bond distances ranging from 2.29-3.15 Å. In the second Tc site, Tc(2) is bonded in a 2-coordinate geometry to two equivalent In(1) atoms. There is one shorter (2.29 Å) and one longer (2.50 Å) Tc(2)-In(1) bond length. In(1) is bonded in a 6-coordinate geometry to two equivalent Tc(2) and four equivalent Cl(1) atoms. There are a spread of In(1)-Cl(1) bond distances ranging from 2.79-2.98 Å. Cl(1) is bonded in a 7-coordinate geometry to three equivalent Tc(1) and four equivalent In(1) atoms.