PM7 Accuracy

phenanthridine    580 Phenanthridine

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    #  Species Formula
   570 2-Methyl-6-t-butylanilineC11H17N
   571 n-UndecanenitrileC11H21N
   572 CarbazoleC12H9N
   573 2-BiphenylamineC12H11N
   574 BiphenylamineC12H11N
   575 2-n-Butyl-2-methylhexanenitrileC12H23N
   576 6,7-BenzoquinolineC13H9N
   577 a-BenzoquinolineC13H9N
   578 AcridineC13H9N
   579 Benzo[f]quinolineC13H9N
   580 Phenanthridine C13H9N
   581 N-MethylcarbazoleC13H11N
   582 1,2,3,4-Tetrahydro-N-methylcarbazoleC13H15N
   583 9-Ethyl-9H-carbazoleC14H13N
   584 TetradecanenitrileC14H27N
   585 DioctylamineC16H35N
   586 TriphenylamineC18H15N
   587 TrioctylamineC24H51N
   588 Nitrogen (Geo)N2
   589 NitrogenN2
   590 DiazeneH2N2


DHf: 57.5 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
Phenanthridine
 H=57.48 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.41118413  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.38039195  1  120.4351295  1    0.0000000  0     2     1     0
  C     1.40697654  1  120.5281491  1   -0.0045588  1     3     2     1
  C     1.37982758  1  119.9692540  1   -0.0012836  1     4     3     2
  C     1.40782590  1  118.6732610  1   -0.0002529  1     1     2     3
  C     1.44570772  1  122.9264694  1  179.9962017  1     1     2     3
  C     1.41368343  1  118.1791030  1  179.9957332  1     7     1     2
  N     1.39360205  1  122.3115277  1   -0.0052741  1     8     7     1
  C     1.44933074  1  118.4146218  1  179.9961783  1     6     1     2
  C     1.40945775  1  123.3606070  1    0.0009641  1     7     1     2
  C     1.38006220  1  120.6107199  1  179.9933851  1    11     7     1
  C     1.40770789  1  120.5529467  1   -0.0030982  1    12    11     7
  C     1.41485650  1  120.5016660  1  179.9967516  1     8     7     1
  H     1.08922541  1  119.6146651  1 -179.9993038  1     2     1     6
  H     1.08974905  1  120.2305441  1  179.9989075  1     3     2     1
  H     1.08843523  1  119.4323857  1 -179.9992325  1     4     3     2
  H     1.08947488  1  120.6270780  1 -179.9998417  1     5     4     3
  H     1.09889148  1  119.1711012  1  179.9951394  1    10     6     1
  H     1.08951772  1  119.5396652  1   -0.0013029  1    11     7     1
  H     1.08896786  1  120.2491676  1 -179.9992312  1    12    11     7
  H     1.08907220  1  119.3321625  1  179.9978138  1    13    12    11
  H     1.09098026  1  118.5809842  1  179.9994059  1    14     8     7