PM7 Accuracy

glutamic acid   1414 Glutamic acid

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    #  Species Formula
  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-dicarboxylateC14H12O4
  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 acid C5H9NO4
  1415 4-NitrocatecholC6H5NO4
  1416 p-Nitrobenzoic acidC7H5NO4
  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


DHf: -189.7 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 PM7
Glutamic acid
 HR=PW91D H=-189.7
  H     0.00233658  1  -0.01184923  1   0.15471110  1
  N     1.00608708  1  -0.09924459  1   0.13268180  1
  C     1.66751776  1   1.11450111  1  -0.35781429  1
  C     1.29650547  1   1.39054065  1  -1.81346931  1
  O     0.82869856  1   0.62042882  1  -2.60708902  1
  C     3.19366505  1   0.93197397  1  -0.25696403  1
  C     3.91893910  1   2.27446213  1  -0.32821142  1
  C     5.39372953  1   2.05045521  1  -0.40508203  1
  O     5.99661332  1   1.05445089  1  -0.70379846  1
  O     6.05767615  1   3.19294491  1  -0.08202161  1
  H     3.56376671  1   0.24233318  1  -1.04574706  1
  H     3.66416727  1   2.91853860  1   0.54250812  1
  H     3.59223569  1   2.86623910  1  -1.21760180  1
  H     3.43160743  1   0.41638084  1   0.70159634  1
  H     1.33778895  1   1.98022950  1   0.28072713  1
  H     1.25140741  1  -0.91906836  1  -0.40482743  1
  O     1.54441812  1   2.68178247  1  -2.14156990  1
  H     1.32824192  1   2.90914093  1  -3.08025220  1
  H     7.04107561  1   3.10675543  1  -0.12645367  1