%chk=000168033.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168033

0 1
 O    2.177300       1.141200       1.742300    
 O    2.349200       1.083600      -1.793400    
 N    1.937800      0.5803000      0.4567000    
 C  -9.8399997E-02 -0.7212000      0.1016000    
 C   -2.214900      -1.812700     -0.2406000    
 C  -0.7169000      -1.977000     -9.0999998E-02
 C   -1.119800      0.3038000      8.9599997E-02
 C   -2.375500     -0.3126000     -0.1105000    
 C    1.274100     -0.6303000      0.2629000    
 C   1.9500000E-02  -3.148000     -0.1244000    
 C   -1.026000       1.677800      0.2366000    
 C   -3.543400      0.4275000     -0.1660000    
 C    2.024000      -1.810100      0.2303000    
 C    1.402900      -3.056200      3.8500000E-02
 C   -2.202400       2.431300      0.1814000    
 C   -3.448500       1.812400     -1.7800000E-02
 C    2.433800       1.362600     -0.5974000    
 C    3.127300       2.647600     -0.1988000    
 H   -2.743700      -2.330400      0.5649000    
 H   -2.545600      -2.153800      -1.225800    
 H  -0.4581000      -4.110200     -0.2721000    
 H  -8.7700002E-02   2.191700      0.3970000    
 H   -4.505500     -4.8500001E-02 -0.3193000    
 H    3.104500      -1.778100      0.3542000    
 H    2.008600      -3.958300      1.7200001E-02
 H   -2.154700       3.511300      0.2954000    
 H   -4.348100       2.421000     -5.6400001E-02
 H    2.975800      0.6468000       1.995500    
 H    2.436400       3.294300      0.3490000    
 H    4.003100       2.425900      0.4171000    
 H    3.459800       3.178600      -1.095700    


%chk=000168033-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168033

0 1
O 1.620867 1.463989 1.452861
O 3.218092 0.632597 -1.680138
N 1.988372 0.663303 0.282312
C -0.123818 -0.677647 0.085292
C -2.239260 -1.842189 -0.098664
C -0.723185 -1.969839 -0.060248
C -1.202501 0.335167 0.132042
C -2.457670 -0.341920 0.014673
C 1.294424 -0.584341 0.118131
C 0.052848 -3.133134 -0.187886
C -1.168991 1.745852 0.243267
C -3.666645 0.374465 0.006589
C 2.076262 -1.760759 -0.014650
C 1.465225 -3.021882 -0.173952
C -2.387903 2.461773 0.226289
C -3.628264 1.786924 0.110236
C 2.918122 1.229516 -0.606853
C 3.507021 2.568585 -0.187325
H -2.721712 -2.395482 0.731378
H -2.659010 -2.252676 -1.037861
H -0.424142 -4.112194 -0.308927
H -0.221617 2.273895 0.365360
H -4.626489 -0.147501 -0.082672
H 3.166571 -1.670525 -0.016741
H 2.089856 -3.914332 -0.285119
H -2.372984 3.554333 0.309568
H -4.561752 2.360937 0.102032
H 1.967937 0.952775 2.237676
H 2.720375 3.335730 -0.084910
H 4.017660 2.498934 0.789215
H 4.227210 2.875945 -0.959975


