%chk=000090407.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090407

0 1
 O   -1.792700       2.179500     -2.2500001E-02
 O    3.885900      -1.451000     -0.4360000    
 O   0.7839000       1.753700     -0.5072000    
 N    1.616900     -7.1699999E-02  0.6551000    
 C    2.974300      0.4103000      0.7735000    
 C  -0.7245000      3.1500001E-02 -1.9999999E-04
 C   0.5980000      0.6410000      1.4300000E-02
 C   -1.875700      0.8191000     -1.8300001E-02
 C    3.827300     -3.0900000E-02 -0.4018000    
 C  -0.8311000      -1.359400      5.5000000E-03
 C   -3.133400      0.2157000     -3.0700000E-02
 C   -2.088800      -1.962500     -6.8999999E-03
 C   -3.239900      -1.175100     -2.4900001E-02
 H    3.370300     -2.9000000E-03   1.707100    
 H    2.965800       1.502300      0.8478000    
 H    1.409100     -0.9506000       1.117300    
 H    4.847800      0.3492000     -0.2986000    
 H    3.419900      0.3219000      -1.354700    
 H   3.9000001E-02  -2.009400     -1.2700000E-02
 H   -4.038800      0.8166000     -4.4900000E-02
 H   -2.172300      -3.045500     -9.8999999E-03
 H   -4.219000      -1.644900     -3.6300000E-02
 H    2.974400      -1.778000     -0.5255000    
 H   -2.690800       2.552700     -3.5300002E-02


%chk=000090407-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090407

0 1
O -1.700654 2.144648 0.320248
O 4.019443 -1.531904 -0.112756
O 0.945719 1.491004 -1.029031
N 1.581148 0.060079 0.691735
C 2.966348 0.570092 0.727480
C -0.733075 -0.025094 -0.078993
C 0.641330 0.594135 -0.189001
C -1.893772 0.775445 0.105417
C 3.859759 -0.087889 -0.342013
C -0.897095 -1.423322 -0.240070
C -3.180545 0.184169 0.113682
C -2.176958 -2.021699 -0.234390
C -3.320129 -1.209492 -0.060691
H 3.381060 0.366193 1.730237
H 2.945164 1.663201 0.558153
H 1.253344 -0.553459 1.439444
H 4.880041 0.325032 -0.279657
H 3.448302 0.118873 -1.349526
H -0.008958 -2.044517 -0.405036
H -4.069179 0.811597 0.261967
H -2.280426 -3.102255 -0.373856
H -4.319971 -1.656615 -0.058265
H 3.130803 -1.957381 -0.221753
H -2.566099 2.620761 0.380875


