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

sb(v)cbr5(-) (jinmic)   5702 Sb(V)CBr5(-) (JINMIC)

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    #  Species Formula
  5692 Antimony tribromideBr3Sb
  5693 Sb(III)Br3 (DEJYEW) (Geo)Br3Sb
  5694 Sb(III)Br3 (DEJYEW)Br3Sb
  5695 Antimony tribromide (Geo)Br3Sb
  5696 Sb(V)C2Br3 (DPSBTB) (Geo)C12H10Br3Sb
  5697 Sb(III)CBr4(2-) (BIMKIR) (Geo)C6H5Br4Sb
  5698 Sb(III)CBr4(2-) (BIMKIR)C6H5Br4Sb
  5699 Sb(III)Br5(2-) (CLPYSB) (Geo)Br5Sb
  5700 Sb(III)Br5(2-) (CLPYSB)Br5Sb
  5701 Sb(V)CBr5(-) (JINMIC) (Geo)C6H5Br5Sb
  5702 Sb(V)CBr5(-) (JINMIC) C6H5Br5Sb
  5703 Sb(V)Br6(-) (CLBRPZ) (Geo)Br6Sb
  5704 Sb(V)Br6(-) (CLBRPZ)Br6Sb
  5705 SbBr6(-)Br6Sb
  5706 SbBr6(-) (Geo)Br6Sb
  5707 Indium antimonideInSb
  5708 InSbH4, complex (Geo)H4InSb
  5709 Antimony, dimerSb2
  5710 Antimony, dimer (Geo)Sb2
  5711 Antimony tartarate (tartar emetic)C8H4O12Sb2
  5712 Antimony tartarate (tartar emetic) (Geo)C8H4O12Sb2


ΔHf: -104.2 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 CHARGE=-1 PM7
Sb(V)CBr5(-) (JINMIC)
 H=-104.2 HR=PW91D
 Sb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.61203776 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.60502906 +1   88.3599993 +1    0.0000000 +0     1     2     0
  C     2.20953132 +1   91.5941529 +1  179.9843368 +1     1     3     2
 Br     2.60514648 +1   88.2240784 +1  -89.8688698 +1     1     2     3
 Br     2.60421543 +1   88.3571303 +1  -90.0685878 +1     1     2     5
  C     1.40105422 +1  120.6493285 +1  -44.4581183 +1     4     1     5
  C     1.39693466 +1  120.5352833 +1  179.8547761 +1     7     4     1
  C     1.39134656 +1  120.4200605 +1    0.0988246 +1     8     7     4
  C     1.39135757 +1  119.4432433 +1    0.0035887 +1     9     8     7
  C     1.40095332 +1  120.7012061 +1  179.9719675 +1     4     1     7
  H     1.09826679 +1  123.4853631 +1  179.9945203 +1     7     4     8
  H     1.08577301 +1  119.6269904 +1  179.9677466 +1     8     7     9
  H     1.08515493 +1  120.2740174 +1  179.9765010 +1     9     8    10
  H     1.08582157 +1  119.9670568 +1  179.9194550 +1    10     9     8
  H     1.09831601 +1  123.5178880 +1    0.0634440 +1    11     4     1
 Br     2.60471341 +1   88.2321041 +1  -89.9346397 +1     1     2     6