PM7 Accuracy

n,n'-bis(p-methoxyphenyl) terephthalamide   1427 N,N'-Bis(p-methoxyphenyl) terephthalamide

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    #  Species Formula
  1417 Dinitrogen tetroxideN2O4
  1418 Dinitrogen tetroxide (Geo)N2O4
  1419 DinitromethaneCH2N2O4
  1420 m-DinitrobenzeneC6H4N2O4
  1421 o-DinitrobenzeneC6H4N2O4
  1422 p-DinitrobenzeneC6H4N2O4
  1423 2,4-DinitrotolueneC7H6N2O4
  1424 DinitrophenylmethaneC7H6N2O4
  1425 N,N'-Bis(m-methoxyphenyl) terephthalamideC22H20N2O4
  1426 N,N'-Bis(o-methoxyphenyl) terephthalamideC22H20N2O4
  1427 N,N'-Bis(p-methoxyphenyl) terephthalamide C22H20N2O4
  1428 MethyldinitramineCH3N3O4
  1429 LiHCO3.2H2OH5LiCO5
  1430 LiHCO3.2H2O (Geo)H5LiCO5
  1431 Tartronic acidC3H4O5
  1432 1,3,5,7,9-pentaoxecaneC5H10O5
  1433 3,5,7,9,11-Pentaoxa-tridecaneC8H18O5
  1434 15-Crown-5C10H20O5
  1435 LiNO3.2H2OH4LiNO5
  1436 LiNO3.2H2O (Geo)H4LiNO5
  1437 Dinitrogen pentoxideN2O5


DHf: -76.6 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
N,N'-Bis(p-methoxyphenyl) terephthalamide
 H=-76.6 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.39332359  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.39329805  1  119.3320365  1    0.0000000  0     2     1     0
  C     1.39341560  1  119.3458869  1   -0.0288365  1     3     2     1
  C     1.39329784  1  121.3156062  1    0.2886198  1     4     3     2
  C     1.39319099  1  121.3264049  1   -0.0745522  1     1     2     3
  C     1.49468025  1  119.1789403  1  177.8948755  1     1     2     3
  C     1.49467793  1  119.5807562  1  178.3569286  1     4     3     2
  O     1.20888658  1  122.7000322  1  -85.3502325  1     7     1     2
  O     1.20860979  1  122.8302782  1  -98.1132650  1     8     4     3
  N     1.38802803  1  113.5429025  1   94.6381012  1     7     1     2
  N     1.38873599  1  113.3954740  1   81.9630517  1     8     4     3
  C     1.41781119  1  125.5377400  1 -179.8233309  1    12     8     4
  C     1.40314522  1  116.8921803  1 -177.3245496  1    13    12     8
  C     1.39199204  1  120.3490761  1 -179.6491743  1    14    13    12
  C     1.39302669  1  118.9208833  1   -0.0256333  1    15    14    13
  C     1.40385632  1  121.3430784  1   -0.0276412  1    16    15    14
  C     1.40474564  1  123.0207092  1    2.9891011  1    13    12     8
  C     1.41789013  1  125.4103282  1 -179.7195561  1    11     7     1
  C     1.39755500  1  123.2239323  1   -3.2539999  1    19    11     7
  C     1.39363626  1  120.0176674  1 -179.7820922  1    20    19    11
  C     1.39207693  1  119.3265068  1    0.0441171  1    21    20    19
  C     1.40480265  1  121.3451668  1    0.0046482  1    22    21    20
  C     1.41022130  1  116.6945694  1  177.0211055  1    19    11     7
  O     1.36161097  1  125.9224519  1  179.9578239  1    22    21    20
  C     1.42029951  1  116.9542688  1    0.3458434  1    25    22    21
  O     1.36161219  1  125.8373202  1  179.9410461  1    16    15    14
  C     1.42006481  1  117.0460249  1    0.2147831  1    27    16    15
  H     1.09073926  1  120.3675982  1 -179.5828681  1     2     1     6
  H     1.09055718  1  120.2340074  1  179.5917754  1     3     2     1
  H     1.09094989  1  120.3503994  1  179.2392319  1     5     4     3
  H     1.09064816  1  120.4083921  1  179.5667498  1     6     1     2
  H     1.01653815  1  118.5346558  1   -0.8307854  1    11     7     1
  H     1.01645351  1  118.4581556  1    1.2896926  1    12     8     4
  H     1.08814537  1  120.4998393  1    0.4121325  1    14    13    12
  H     1.08509945  1  119.6220682  1  179.9919621  1    15    14    13
  H     1.08904474  1  119.5411091  1 -179.9368459  1    17    16    15
  H     1.09448762  1  120.8791308  1   -0.3661818  1    18    13    12
  H     1.09391132  1  121.0498984  1    0.2379400  1    20    19    11
  H     1.08593679  1  119.2385021  1 -179.9627350  1    21    20    19
  H     1.08808548  1  119.5665335  1  179.9945494  1    23    22    21
  H     1.08871306  1  120.3255402  1   -0.3042432  1    24    19    11
  H     1.09853612  1  102.1545832  1  179.7807905  1    26    25    22
  H     1.09441601  1  110.9979074  1   62.1049616  1    26    25    22
  H     1.09440178  1  110.9734098  1  -62.5539037  1    26    25    22
  H     1.09884411  1  102.1259105  1 -179.8308424  1    28    27    16
  H     1.09421003  1  110.9883344  1   62.5065520  1    28    27    16
  H     1.09417043  1  111.0359587  1  -62.1616681  1    28    27    16