PM7 Accuracy

quinoline    546 Quinoline

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    #  Species Formula
   536 N-Ethyl anilineC8H11N
   537 3-Azabicyclo[3.2.2]nonaneC8H15N
   538 n-Heptyl cyanideC8H15N
   539 N-(2-Methylpropylidene)-butylamineC8H17N
   540 2-Methyl-N-(2-methylpropyl)-1-propanamineC8H19N
   541 Di-sec-butylamineC8H19N
   542 DibutylamineC8H19N
   543 N-(2-Methylpropyl)-1-butanamineC8H19N
   544 n-OctylamineC8H19N
   545 IsoquinolineC9H7N
   546 Quinoline C9H7N
   547 2,6-DimethylbenzonitrileC9H9N
   548 (1a,2a,4a)-Bicyclo[2.2.2]oct-5-ene-2-carbonitrileC9H11N
   549 (1a,2b,4a)-Bicyclo[2.2.2]oct-5-ene-2-carbonitrileC9H11N
   550 1,2,3,4-TetrahydroquinolineC9H11N
   551 5,6,7,8-TetrahydroquinolineC9H11N
   552 N,N-Dimethyl m-toluidineC9H13N
   553 N,N-Dimethyl p-toluidineC9H13N
   554 N-Ethyl m-toluidineC9H13N
   555 cis-3,7a-H-cis-5,8-H-3,5-DimethylpyrrolizidineC9H17N
   556 Decahydro trans-quinolineC9H17N


DHf: 47.9 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Quinoline
 H=47.925 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.36957212  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.41934641  1  120.6444763  1    0.0000000  0     2     1     0
  C     1.37117466  1  120.6816201  1    0.0084898  1     3     2     1
  C     1.41947708  1  120.1547812  1    0.0077646  1     4     3     2
  C     1.42598989  1  119.6055453  1    0.0053816  1     1     2     3
  N     1.37671454  1  118.3746906  1 -179.9990797  1     6     1     2
  C     1.31976133  1  118.7548570  1  179.9979565  1     7     6     1
  C     1.42849270  1  123.1637034  1    0.0010222  1     8     7     6
  C     1.42232310  1  122.9456664  1 -179.9992700  1     5     4     3
  H     1.09083932  1  122.2277476  1 -179.9993569  1     1     2     3
  H     1.08985699  1  120.6575875  1 -179.9989342  1     2     1     6
  H     1.08932402  1  118.6089168  1  179.9990704  1     3     2     1
  H     1.08894731  1  121.0650408  1  179.9999332  1     4     3     2
  H     1.09765972  1  116.6339134  1 -179.9997643  1     8     7     6
  H     1.08595937  1  119.2496337  1 -179.9982699  1     9     8     7
  H     1.08974710  1  119.0488522  1    0.0014516  1    10     5     4