21
4-NO2PhN2~HSO4_UB3LYP-aug-cc-pVDZ-Opt
 C         2.794100183487     -0.247119015008      0.086976980350
 C         2.457617752797      0.955066903312      0.703705050392
 C         1.645665282109      1.835141675245     -0.021028196882
 C         1.145942754189      1.582075649458     -1.307131109452
 C         1.492955889458      0.375369868689     -1.900992577020
 C         2.311596111848     -0.510488573144     -1.194831179885
 H         3.411373200633     -0.982012910141      0.596531870913
 H         2.746922322803      1.201127363816      1.722914279940
 H         0.498501166417      2.297934713218     -1.807841455363
 H         1.136063893219      0.111014097243     -2.892749502104
 N         2.680337397823     -1.796272732298     -1.842922306304
 O         3.412726265272     -2.551169735171     -1.215963983492
 O         2.228146573419     -2.009415841757     -2.962145225127
 N         1.346972468228      3.087384757675      0.536917365335
 N         1.240233067347      4.152350727258      0.829452974522
 S        -0.085416023987      1.648087943291      2.948071413532
 O         0.224202524202     -0.018559289475      2.853893379786
 H        -0.466770588499     -0.435847875142      3.390370765533
 O        -0.610225019672      1.999637602049      1.566059909932
 O        -1.064545156952      1.795818035917      4.053217397221
 O         1.291229935861      2.225276634964      3.149684148174
