PM7 Accuracy

dimethyl naphthalene-2,6-dicarboxylate   1409 Dimethyl naphthalene-2,6-dicarboxylate

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    #  Species Formula
  1399 Be(II)O4 (ACACBE02)H14BeC10O4
  1400 Benzal diacetateC11H12O4
  1401 1-Butoxy-1-tert-butyldioxy-2-propanolC11H24O4
  1402 1,1-Ethanediol, 2-phenyl-, diacetateC12H14O4
  1403 Benzyl diacetateC12H14O4
  1404 Be(II)O4(2-) (YAMBOD) (Geo)H8BeC12O4
  1405 Be(II)O4(2-) (YAMBOD)H8BeC12O4
  1406 1,4,9,10-AnthracenetetroneC14H6O4
  1407 1,4-Dihydroxy-9,10-anthracenedioneC14H8O4
  1408 Diphenyl oxalateC14H10O4
  1409 Dimethyl naphthalene-2,6-dicarboxylate C14H12O4
  1410 Li(I)2(Cp)2O4 (DANPOX) (Geo)C16H26Li2O4
  1411 Li(I)2(Cp)2O4 (DANPOX)C16H26Li2O4
  1412 p-Diacetylbenzene diethyl ketalC18H30O4
  1413 Aspartic acidC4H7NO4
  1414 Glutamic acidC5H9NO4
  1415 4-NitrocatecholC6H5NO4
  1416 p-Nitrobenzoic acidC7H5NO4
  1417 Dinitrogen tetroxideN2O4
  1418 Dinitrogen tetroxide (Geo)N2O4
  1419 DinitromethaneCH2N2O4


DHf: -132.7 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
Dimethyl naphthalene-2,6-dicarboxylate
 H=-132.7 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.36954551  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.42025615  1  119.8907394  1    0.0000000  0     2     1     0
  C     1.37297814  1  120.9914096  1    0.0011636  1     3     2     1
  C     1.42235039  1  119.9178337  1    0.0157037  1     4     3     2
  C     1.41261611  1  119.2095452  1    0.0389918  1     5     4     3
  C     1.42227529  1  119.2285269  1  179.9351427  1     6     5     4
  C     1.37290933  1  119.9169539  1   -0.0078725  1     7     6     5
  C     1.42014803  1  120.9720359  1    0.0594863  1     8     7     6
  C     1.36950449  1  119.9217578  1   -0.0894597  1     9     8     7
  C     1.47617156  1  122.0570386  1  179.9134465  1     8     7     9
  O     1.20486817  1  127.0705501  1 -177.8221761  1    11     8     7
  O     1.35996938  1  110.8218430  1 -179.9336157  1    11     8    12
  C     1.42448146  1  115.7592789  1 -179.9018818  1    13    11     8
  C     1.47620082  1  116.9076361  1 -179.9469706  1     3     2     4
  O     1.20493613  1  126.9946913  1    1.9798644  1    15     3     2
  O     1.35990157  1  110.8724879  1 -179.9343770  1    15     3    16
  C     1.42454745  1  115.7453788  1 -179.8525410  1    17    15     3
  H     1.08980836  1  120.7843697  1  179.9813078  1     1     2     3
  H     1.09389835  1  121.4595153  1 -179.9342801  1     2     1     3
  H     1.09297878  1  121.1222497  1 -179.9849032  1     4     3     5
  H     1.09293575  1  118.9447582  1 -179.9695643  1     7     6     8
  H     1.09390440  1  118.6200657  1  179.9673212  1     9     8    10
  H     1.08980143  1  120.8072427  1 -179.9865544  1    10     9     8
  H     1.09548211  1  110.1924808  1  -61.0359679  1    14    13    11
  H     1.09534440  1  110.2229054  1  122.0118436  1    14    13    25
  H     1.09593053  1  102.9296972  1  119.0234681  1    14    13    26
  H     1.09553366  1  110.2871133  1  -59.7393994  1    18    17    15
  H     1.09532840  1  110.1129668  1  121.9823056  1    18    17    28
  H     1.09591537  1  102.9408843  1  118.9995375  1    18    17    29