PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

v2cl4r   3129 Vanadium(II) chloride, dimer (Geo)

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    #  Species Formula
  3119 Vanadium, dimer (Geo)V2
  3120 V2C16 (CAMXAP) (Geo)C16H16V2
  3121 V(IV)2O6 (BIWDIU) (Geo)C12H20O8V2
  3122 V(V)2O8N4 (CEKHUV) (Geo)C22H20N4O8V2
  3123 V(V)2O8N4 (CEKHUV)C22H20N4O8V2
  3124 V(V)2O10 (BAFNEB) (Geo)C14H26O10V2
  3125 V(IV)2F6O4(2-) (BAHLUR) (Geo)H4O4F6V2
  3126 V2C10O8 (CPVFAC) (Geo)C18H10O8F12V2
  3127 V(III)2S8Cl2 (ALACIZ) (Geo)C28H24S8Cl2V2
  3128 Vanadium(II) chloride, dimerCl4V2
  3129 Vanadium(II) chloride, dimer (Geo) Cl4V2
  3130 V2Cl6Cl6V2
  3131 V2Cl6 (Geo)Cl6V2
  3132 V(IV)2Cl9(-) (DOTPAD) (Geo)Cl9V2
  3133 V(IV)2Cl9(-) (DOTPAD)Cl9V2
  3134 Chromium, cationCr
  3135 Chromium, atomCr
  3136 Chromium, anionCr
  3137 Cr(III)C6(3-) (MCRLDX) (Geo)C6H18Cr
  3138 Bicyclopentadienyl chromiumC10H10Cr
  3139 Dibenzene chromiumC12H12Cr


REF: Hirota, T. Iijima, K. Kuchitsu, W. J. Lafferty, and D. A. Ramsay, "Structure Data on Free Polyatomic Molecules," Landolt-Bornstein, New Series, Group II, Vol. 21, Springer, Berlin (1992).
  
 PULAY SHIFT=80 UHF SYMMETRY PM7
Vanadium(II) chloride, dimer
 <V-Cl(t)> <V-Cl(b)> <> <Cl(b)-V-Cl(b)> GR=HIKL1992
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  V     2.17200000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.34100000 +1  154.5042792 +1    0.0000000 +0     2     1     0
 Cl     2.34100000 +0   98.1000000 +1  180.0000000 +0     2     3     1
  V     2.34100000 +0   80.2060632 +1    0.0000000 +0     4     2     3
 Cl     2.17200000 +0  180.0000000 +0    0.0000000 +0     5     2     3