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

sobr2r   4300 Thionyl bromide (Geo)

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    #  Species Formula
  4290 Magnesium dibromide (Geo)MgBr2
  4291 Mg(II)O2Br2 (MGBEET) (Geo)C8H20O2MgBr2
  4292 Mg(II)O2Br2 (MGBEET)C8H20O2MgBr2
  4293 Mg(II)O5Br2 (GUPJAC) (Geo)C10H22O5MgBr2
  4294 Mg(II)O5Br2 (GUPJAC)C10H22O5MgBr2
  4295 Silicon dibromideSiBr2
  4296 DibromosilaneH2SiBr2
  4297 SiH2CBr (ZUHPIB) (Geo)C2H8Si2Br2
  4298 SiH2CBr (ZUHPIB)C2H8Si2Br2
  4299 Sulfur dibromideSBr2
  4300 Thionyl bromide (Geo) OSBr2
  4301 Dibromine disulfideS2Br2
  4302 Potassium bromide, dimer (Geo)K2Br2
  4303 Potassium bromide, dimerK2Br2
  4304 Calcium dibromide (Geo)CaBr2
  4305 Calcium dibromideCaBr2
  4306 Ca(II)N2O2Br2 (TAPKEA) (Geo)C12H18N2O2CaBr2
  4307 Ca(II)N2O2Br2 (TAPKEA)C12H18N2O2CaBr2
  4308 Titanium dibromideTiBr2
  4309 Titanium(IV) oxide dibromide (Geo)OTiBr2
  4310 Titanium(IV) oxide dibromideOTiBr2


REF: J. H. Callomon, E. Hirota, T. Iijima, K. Kuchitsu, W. J. Lafferty, "Structure Data on Free Polyatomic Molecules," Landolt-Bornstein, New Series, Group II, Vol. 15, Springer, Berlin (1977).
  
 PM7
Thionyl bromide
 <S=O> <S-Br> <Br-S-O> <Br-S-Br> GR=CHIK1986
  S     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.44900000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.25500000 +1  107.6000000 +1    0.0000000 +0     1     2     0
 Br     2.25500000 +1   98.4084000 +1  111.6875686 +1     1     3     2