16
4-NO2PhN2~Cl_UB3LYP-aug-cc-pVDZ-Water-Opt
 C        -1.484071497237     -1.581324107523     -1.329296275507
 C        -0.100700753276     -1.445593584207     -1.277067816929
 C         0.414021584960     -0.235380294984     -0.796163688280
 C        -0.371882539156      0.844982122133     -0.365430799142
 C        -1.753344879883      0.691687640028     -0.424687860588
 C        -2.275248136643     -0.512338692117     -0.903007246839
 H        -1.942305403505     -2.496207176571     -1.692699824542
 H         0.562173588468     -2.245833235702     -1.596316562071
 H         0.105362844899      1.755182479031     -0.003791934092
 H        -2.416027818563      1.491066454958     -0.105824802512
 N        -3.750215003452     -0.664351701400     -0.961603780916
 O        -4.435887943394      0.280402892875     -0.584807325248
 O        -4.197574074322     -1.725745966390     -1.383455406950
 N         1.801441871563     -0.077588076415     -0.734965490719
 N         2.803461105517      0.396111986339     -0.546527115738
 Cl        2.521997054023      2.772929259944      0.402145930071
