18
4-MeOPhN2~Br_UB3LYP-aug-cc-pVDZ-Opt
 C        -1.321985347325     -1.712242234331     -1.514828106585
 C         0.013144765960     -1.366284844413     -1.617791114575
 C         0.502668141532     -0.260188718810     -0.896625375648
 C        -0.341346942420      0.499736905726     -0.073106773456
 C        -1.684852598753      0.147354724799      0.027205379708
 C        -2.181996792487     -0.956831840913     -0.690358493321
 H        -1.729291231784     -2.561784346621     -2.060015477236
 H         0.693175926649     -1.936632216296     -2.248812288257
 H         0.062511936184      1.349778808711      0.473425117512
 H        -2.333999010802      0.739652155886      0.666650557900
 N         1.866431440577      0.029377808238     -1.051244528930
 N         2.728678751515      0.748266162578     -0.733756232458
 Br        2.302690654751      2.494700315895      0.738096729723
 O        -3.467582508932     -1.373234872053     -0.655764756078
 C        -4.404254539032     -0.659739899408      0.157515521781
 H        -5.358988280602     -1.175380178875      0.023250327707
 H        -4.497487911823      0.384239197377     -0.174356337297
 H        -4.110916453209     -0.693686927490      1.216535849510
