%chk=000161234.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161234

1 1
 O    1.495300      0.5217000       1.072400    
 O    2.095200      -2.202500      -1.192700    
 O    4.042300     -0.8772000      0.1620000    
 O    1.713900       3.256200      0.4879000    
 O   -2.577500       2.267900     -0.3958000    
 O   -4.519800       1.088200     -0.4410000    
 N  -0.3039000     -0.9594000      0.3909000    
 C    1.846800     -0.8640000     -0.8160000    
 C    3.114800     -7.2400004E-02 -0.5663000    
 C    1.161900     -0.7721000      0.5356000    
 C    2.623000       1.052300      0.3391000    
 C    2.159100       2.278000     -0.4354000    
 C   -1.080500      0.1072000      0.1277000    
 C  -0.8247000      -2.192700      0.5257000    
 C   -2.453100     -3.8699999E-02 -1.3600000E-02
 C   -2.190700      -2.398300      0.3951000    
 C   -3.010000      -1.306800      0.1225000    
 C   -3.292200       1.112800     -0.2980000    
 H    1.248400     -0.3859000      -1.599600    
 H    3.608000      0.2598000      -1.484200    
 H    1.518600      -1.527900       1.246300    
 H    3.371500       1.344300       1.084400    
 H    1.329100       2.053400      -1.111900    
 H    2.979300       2.705700      -1.019400    
 H    2.667500      -2.603900     -0.5168000    
 H    4.822300     -0.3262000      0.3456000    
 H  -0.5748000       1.056800      2.2500001E-02
 H  -0.1361000      -3.002800      0.7336000    
 H   -2.612000      -3.392100      0.5023000    
 H   0.9901000       2.863500       1.005400    
 H   -4.080200      -1.464400      1.9200001E-02
 H   -3.153800       3.038300     -0.5874000    


%chk=000161234-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161234

1 1
O 1.244575 0.861298 0.621401
O 2.204271 -2.488391 -0.524328
O 3.991979 -0.953069 0.582620
O 2.195182 3.547082 -0.180567
O -3.138353 2.257828 0.489017
O -4.951096 0.843863 0.064890
N -0.429037 -0.823231 0.294249
C 1.950264 -1.074381 -0.608963
C 3.213179 -0.190032 -0.400523
C 1.038818 -0.559773 0.548691
C 2.673620 1.147354 0.168838
C 2.621825 2.313557 -0.825231
C -1.337281 0.200844 0.363699
C -0.810493 -2.122991 0.025534
C -2.702737 -0.064867 0.154336
C -2.162016 -2.420572 -0.190272
C -3.124885 -1.387435 -0.123385
C -3.729753 1.029498 0.225350
H 1.479404 -0.868592 -1.585671
H 3.779582 -0.050991 -1.339580
H 1.300179 -1.071040 1.497380
H 3.225967 1.449544 1.075808
H 1.981437 2.053513 -1.695898
H 3.642564 2.525443 -1.188829
H 3.032955 -2.600458 0.025827
H 4.938317 -0.671414 0.611695
H -0.947823 1.193812 0.587760
H -0.003657 -2.862180 -0.025034
H -2.449274 -3.451507 -0.407562
H 1.260785 3.456764 0.135503
H -4.190929 -1.582212 -0.279544
H -3.819769 2.981534 0.542891


