16
4-HOOCPhN2+_UB3LYP-aug-cc-pVDZ-Opt
 C         1.088566849672     -1.244393893302     -0.000061818097
 C         1.760347426087     -0.005224174582      0.000007159531
 C         1.115317464185      1.249375497181      0.000046797895
 C        -0.271539643952      1.241795595194      0.000015072680
 C        -0.976399794781      0.024294702337     -0.000054023468
 C        -0.300038116294     -1.209275074587     -0.000090161289
 H         1.640078405117     -2.183112948494     -0.000092047158
 H         1.686667502951      2.176119679856      0.000101746236
 H        -0.832387267406      2.175289797272      0.000037976026
 H        -0.864122648653     -2.139341155237     -0.000143163279
 N         3.144741392198     -0.020786489428      0.000037805195
 N         4.258212205842     -0.031111196785      0.000061945467
 C        -2.484585849682      0.104718990125     -0.000103464147
 O        -3.077658807353      1.155484641795      0.000146214509
 O        -3.055123784124     -1.111294071011      0.000104975536
 H        -4.021775333808     -0.999139900335      0.000284984363
