%chk=000077352.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077352

0 1
 O    4.457800       1.025600       1.034200    
 O   0.9853000      -1.499700     -0.1522000    
 N    2.240600      0.3718000     -0.6677000    
 N  -4.2199999E-02  0.6039000     -0.3777000    
 C    3.519300     -0.2978000     -0.7339000    
 C   -1.389500      0.3352000     -0.1342000    
 C    4.212400     -0.3109000      0.6163000    
 C    1.045300     -0.2929000     -0.3757000    
 C   -2.326300       1.367500     -0.1832000    
 C   -1.799600     -0.9656000      0.1585000    
 C   -3.673300       1.098900      6.0500000E-02
 C   -3.146500      -1.234100      0.4020000    
 C   -4.083400     -0.2019000      0.3529000    
 H    4.119900      0.2543000      -1.464300    
 H    3.375800      -1.320400      -1.097100    
 H    2.213100       1.372900     -0.8348000    
 H    5.174100     -0.8276000      0.5480000    
 H    3.605300     -0.8070000       1.380400    
 H   0.1822000       1.574300     -0.5836000    
 H   -2.021000       2.385900     -0.4100000    
 H   -1.135300      -1.816400      0.2150000    
 H   -4.402900       1.902400      2.2399999E-02
 H   -3.467100      -2.246500      0.6300000    
 H   -5.132200     -0.4109000      0.5426000    
 H    3.597300       1.474500       1.095300    


%chk=000077352-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077352

0 1
O 4.542761 0.865478 1.227382
O 1.081089 -1.371030 -0.055726
N 2.274505 0.524154 -0.702415
N -0.053027 0.675062 -0.429956
C 3.544600 -0.224236 -0.780465
C -1.401824 0.318154 -0.144904
C 4.198482 -0.419554 0.601172
C 1.087434 -0.143820 -0.374767
C -2.382948 1.340030 -0.271948
C -1.796974 -0.987389 0.253253
C -3.739128 1.064234 -0.005757
C -3.159843 -1.245294 0.516157
C -4.138810 -0.233088 0.391300
H 4.230726 0.344601 -1.432567
H 3.354515 -1.214448 -1.235045
H 2.256884 1.481014 -1.056157
H 5.157993 -0.950558 0.486629
H 3.529450 -1.019447 1.248444
H 0.082225 1.650963 -0.702644
H -2.083474 2.351197 -0.579580
H -1.041263 -1.768735 0.349105
H -4.481886 1.863168 -0.108847
H -3.456250 -2.254943 0.822636
H -5.192119 -0.449121 0.598577
H 3.695981 1.339110 1.429824


