Accuracy

v(co)6r   3054 Vanadium hexacarbonyl (Geo)

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    #  Species Formula
  3044 V(IV)O6(2-) (BOBWOE) (Geo)C12H8O5V
  3045 V(IV)O6(2-) (BOBWOE)C12H8O5V
  3046 V(IV)O5N (CUCWUS) (Geo)C15H19NO5V
  3047 V(IV)O3N3 (CAGSAE) (Geo)C14H13N3O5V
  3048 V(IV)O3N3 (CAGSAE)C14H13N3O5V
  3049 VO(H2O)5 (Geo)H10O6V
  3050 V(III)O6(3+) (COLNUM) (Geo)H12O6V
  3051 V(III)O6(3+) (COLNUM)H12O6V
  3052 V(II)(H2O)6H12O6V
  3053 V(II)(H2O)6 (Geo)H12O6V
  3054 Vanadium hexacarbonyl (Geo) C6O6V
  3055 V(CO)6(-) (BOBHIJ) (Geo)C6O6V
  3056 V(CO)6(-) (BOBHIJ)C6O6V
  3057 V(II)O6(2+) (DATBUV) (Geo)C6H18O6V
  3058 V(IV)O6(2-) (BOBWEU) (Geo)C18H12O6V
  3059 V(IV)O6(2-) (BOBWEU)C18H12O6V
  3060 Vanadium(III) EDTA (Geo)C10H12N2O8V
  3061 Vanadium(III) EDTAC10H12N2O8V
  3062 V(V)O6(3-) (AOXOVA) (Geo)C4O10V
  3063 V(V)O6(3-) (AOXOVA)C4O10V
  3064 V(IV)O6(2-) (AOXVAN10) (Geo)C4H2O10V


REF: D. G. Schmidling, J. Mol. Struct., 24, 1 (1975).
  
 OPEN(5,3) BFGS ITRY=2000 SHIFT=20 SYMMETRY PM7
Vanadium hexacarbonyl
 <V-C> GR=DGS75
 
  V     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.01200000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.01200000 +0   90.0000000 +0    0.0000000 +0     1     2     0
  C     2.01200000 +0   90.0000000 +0  180.0000000 +0     1     2     3
  C     2.01200000 +0  180.0000000 +0    0.0000000 +0     1     2     3
  C     2.01200000 +0   90.0000000 +0   90.0000000 +0     1     2     3
  C     2.01200000 +0   90.0000000 +0  -90.0000000 +0     1     2     3
  O     1.15498423 +1  180.0000000 +0    0.0000000 +0     2     1     3
  O     1.15498423 +0  180.0000000 +0    0.0000000 +0     4     1     5
  O     1.15498423 +0  180.0000000 +0    0.0000000 +0     5     1     3
  O     1.15498423 +0  180.0000000 +0    0.0000000 +0     6     1     3
  O     1.15498423 +0  180.0000000 +0    0.0000000 +0     7     1     3
  O     1.15498423 +0  180.0000000 +0    0.0000000 +0     3     1     5
 
   2  1    3    4    5    6    7
   8  1    9   10   11   12   13