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

chccnr    470 CH.C.CN (Geo)

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    #  Species Formula
   460 Methyl isocyanide (Geo)C2H3N
   461 Methyl isocyanideC2H3N
   462 Ethyleneimine (Azirane) (Geo)C2H5N
   463 Ethyleneimine (Azirane)C2H5N
   464 Dimethyl nitrogen, anionC2H6N
   465 DimethylamineC2H7N
   466 EthylamineC2H7N
   467 Dimethylamine (Geo)C2H7N
   468 N,N-Dimethylamine diboraneC2H11B2N
   469 CH.C.CNHC3N
   470 CH.C.CN (Geo) HC3N
   471 AcrylonitrileC3H3N
   472 Acrylonitrile (Geo)C3H3N
   473 Ethyl cyanideC3H5N
   474 CyclopropylamineC3H7N
   475 IsopropylamineC3H9N
   476 Trimethylamine (Geo)C3H9N
   477 n-PropylamineC3H9N
   478 TrimethylamineC3H9N
   479 Trimethyamine-Borane adductH12BC3N
   480 Trimethylborane-Ammonia adductH12BC3N


REF: C. C. Costain, J. Chem. Phys., 29, 864 (1958).
  
 PM7
CH.C.CN
 <N-C3> <C3-C2> <C2-C1> <C-H> GR=CCC1958
  N     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.15900000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.37800000 +1  180.0000000 +0    0.0000000 +0     2     1     0
  C     1.20500000 +1  180.0000000 +0  180.0000000 +0     3     2     1
  H     1.05700000 +1  180.0000000 +0  180.0000000 +0     4     3     2