Accuracy
 cf3ir 
 
  5859 Trifluoroiodomethane (Geo)
  
   
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  REF:  M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
  
 SYMMETRY PM7
Trifluoroiodomethane
 GWT=0.5 GR=JANAF86 <C-I> <C-F> <F-C-I>
 
  I     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     2.13000000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.33200000 +1  110.6200000 +1    0.0000000 +0     2     1     0
  F     1.33200000 +1  110.6200000 +1  120.0000000 +1     2     1     3
  F     1.33200000 +1  110.6200000 +1 -120.0000000 +1     2     1     3
 
   3  1    4    5
   3  2    4    5