Accuracy

Tc(IV)S2Cl4 (WAJFOD) r   4991 Tc(IV)S2Cl4 (WAJFOD) (Geo)

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    #  Species Formula
  4981 Tc(II)N4Cl2 (ZOPWAC)C20H20N4Cl2Tc
  4982 Tc(III)P4Cl2(+) (BAJDOF10) (Geo)C12H32P4Cl2Tc
  4983 Technetium(III) trichloride (Geo)Cl3Tc
  4984 Technetium(III) trichlorideCl3Tc
  4985 Tc(III)N3Cl3 (JEVMAY) (Geo)C18H21N3Cl3Tc
  4986 Tc(III)N3Cl3 (JEVMAY)C18H21N3Cl3Tc
  4987 Technetium(II) tetrachloride 6A1Cl4Tc
  4988 Tc(V)Cl4O(-) (VAVVAP01) (Geo)OCl4Tc
  4989 Tc(V)Cl4O(-) (VAVVAP01)OCl4Tc
  4990 Tc(IV)Cl4P2 (LALGUA) (Geo)C6H18P2Cl4Tc
  4991 Tc(IV)S2Cl4 (WAJFOD) (Geo) C8H16S2Cl4Tc
  4992 Tc(IV)S2Cl4 (WAJFOD)C8H16S2Cl4Tc
  4993 Tc(IV)Cl6(2-) (CIMFEJ) (Geo)Cl6Tc
  4994 Tc(IV)Cl6(2-) (CIMFEJ)Cl6Tc
  4995 Technetium(I) bromide (Geo)BrTc
  4996 Technetium(I) bromideBrTc
  4997 Technetium(III) oxide bromide (Geo)OBrTc
  4998 Technetium(III) oxide bromideOBrTc
  4999 Tc(CO)5BrC5O5BrTc
  5000 Tc(CO)5Br (Geo)C5O5BrTc
  5001 Technetium(III) tribromide (Geo)Br3Tc


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 UHF PM7
Tc(IV)S2Cl4 (WAJFOD)
 <Tc-Cl> <><Cl-Tc-Cl> <Tc-S> GR=CCDC
 Tc     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.31664600 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.31967842 +1   89.7372740 +1    0.0000000 +0     1     2     0
  S     2.49437200 +1   89.4000056 +1   87.7889712 +1     1     2     3
  C     1.83741612 +1  106.6463889 +1  -37.5363913 +1     4     1     2
  H     1.11068610 +1  113.2411091 +1   -5.8809380 +1     5     4     1
  H     1.10557795 +1  109.3486490 +1  117.4811832 +1     5     4     6
  C     1.52466676 +1  105.2116537 +1  121.5121664 +1     5     4     7
  H     1.10846955 +1  110.6960352 +1  156.2137277 +1     8     5     4
  H     1.10740548 +1  111.4300077 +1  116.6722657 +1     8     5     9
  C     1.53734684 +1  108.5825560 +1  122.1167928 +1     8     5    10
  H     1.10598677 +1  110.7515141 +1 -164.5612125 +1    11     8     5
  H     1.11307177 +1  110.1129161 +1 -115.5834062 +1    11     8    12
  C     1.52484737 +1  109.1768898 +1 -121.8188835 +1    11     8    13
  H     1.10653056 +1  112.0462106 +1  -90.2075610 +1    14    11     8
  H     1.10936606 +1  111.5169864 +1 -117.9650811 +1    14    11    15
 Cl     2.32564932 +1   89.2990430 +1 -179.7909554 +1     1     4     2
 Cl     2.32132147 +1   90.6763678 +1   91.0272305 +1     1     2     4
  S     2.40204952 +1   90.5760885 +1   88.9718461 +1     1     2    18
  C     1.83754020 +1  107.3834070 +1 -143.4600594 +1    19     1     2
  H     1.11171577 +1  113.5565126 +1    6.8039191 +1    20    19     1
  H     1.10608310 +1  109.3361371 +1 -117.4325640 +1    20    19    21
  C     1.52451308 +1  105.1251388 +1 -121.4838707 +1    20    19    22
  H     1.10876337 +1  110.6706184 +1 -156.2639944 +1    23    20    19
  H     1.10742040 +1  111.4947421 +1 -116.6207729 +1    23    20    24
  C     1.53711083 +1  108.5893055 +1 -122.2379110 +1    23    20    25
  H     1.10615571 +1  110.7610456 +1  164.7607938 +1    26    23    20
  H     1.11344380 +1  110.1425241 +1  115.5006795 +1    26    23    27
  C     1.52458410 +1  109.1730897 +1  121.8573734 +1    26    23    28
  H     1.10703797 +1  112.0790094 +1   89.9361728 +1    29    26    23
  H     1.11013889 +1  111.4356731 +1  117.7633395 +1    29    26    30