%chk=000086299.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086299

0 1
 O   -2.096500      -2.173000      0.4665000    
 O   0.2786000      -1.906900     -0.5702000    
 O    5.775800       1.629000      0.4865000    
 N    1.230200      0.1747000     -5.4000001E-02
 C   -3.554700     -0.2829000      0.1600000    
 C   -3.709900       1.077100     -0.1995000    
 C   -1.164900     -0.1092000     -0.2614000    
 C   -2.275300     -0.8609000      0.1239000    
 C   -2.581200       1.819000     -0.5844000    
 C   -1.317500       1.228300     -0.6147000    
 C   -4.683500      -1.024500      0.5453000    
 C   -4.989200       1.655400     -0.1634000    
 C   0.1657000     -0.7010000     -0.3029000    
 C    2.618600     -0.1061000     -5.1100001E-02
 C   -5.947000     -0.4337000      0.5752000    
 C   -6.099700      0.9036000      0.2215000    
 C    3.514100      0.9141000      0.2206000    
 C    3.048600      -1.393900     -0.3217000    
 C    4.881400      0.6380000      0.2218000    
 C    4.415700      -1.670000     -0.3206000    
 C    5.332200     -0.6542000     -4.8700001E-02
 C    7.158500       1.277100      0.4712000    
 H   -2.679200       2.863600     -0.8729000    
 H  -0.4899000       1.842200     -0.9586000    
 H   -4.621700      -2.066100      0.8476000    
 H   -5.131900       2.699200     -0.4353000    
 H    1.011600       1.135700      0.1958000    
 H   -6.811800      -1.016800      0.8785000    
 H   -7.083500       1.363100      0.2461000    
 H    3.167600       1.922500      0.4314000    
 H    2.404600      -2.232200     -0.5407000    
 H    4.767200      -2.676100     -0.5313000    
 H   -2.881200      -2.690000      0.2250000    
 H    6.378900     -0.9380000     -6.4099997E-02
 H    7.396200      0.5450000       1.250400    
 H    7.725600       2.184800      0.7020000    
 H    7.478000      0.9446000     -0.5223000    


%chk=000086299-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086299

0 1
O -1.960105 -2.036177 0.818455
O 0.319014 -1.975440 -1.150581
O 5.612000 1.536045 0.956460
N 1.224070 -0.049229 -0.141190
C -3.556164 -0.216081 0.257191
C -3.759172 1.068365 -0.382708
C -1.178506 -0.172725 -0.453616
C -2.244776 -0.819313 0.194350
C -2.659211 1.712651 -1.035567
C -1.404772 1.105424 -1.061056
C -4.662168 -0.832291 0.931547
C -5.062380 1.665388 -0.339338
C 0.169496 -0.842112 -0.611149
C 2.624535 -0.301603 -0.192084
C -5.920066 -0.225311 0.956238
C -6.123911 1.034966 0.311648
C 3.475260 0.677135 0.376984
C 3.179349 -1.471982 -0.782685
C 4.876062 0.497061 0.360815
C 4.579084 -1.625783 -0.787768
C 5.445854 -0.660419 -0.225481
C 7.069801 1.404386 0.973519
H -2.818009 2.680851 -1.522320
H -0.573197 1.587939 -1.587339
H -4.544238 -1.792858 1.451141
H -5.210188 2.634400 -0.830302
H 0.945355 0.812858 0.334643
H -6.752936 -0.711401 1.474998
H -7.114044 1.502335 0.335927
H 3.074213 1.586666 0.839179
H 2.517807 -2.225358 -1.210999
H 5.009661 -2.525733 -1.241169
H -2.780206 -2.501613 1.114867
H 6.527866 -0.816327 -0.247855
H 7.387744 0.508433 1.541765
H 7.434273 2.311418 1.477914
H 7.483105 1.356932 -0.052935


