%chk=000041166.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041166

0 1
 O    1.563500      -2.147300     -5.6200001E-02
 O    3.048300      0.3351000       1.733800    
 O    3.608700      0.2577000     -0.4675000    
 N  -0.7290000      -1.832100     -0.4571000    
 N   0.8383000       1.245900      -2.368500    
 C   0.3903000     -0.1495000      0.7768000    
 C   -1.059900      0.1778000      0.5614000    
 C    1.338400      0.8848000      0.1948000    
 C   -1.665800     -0.8493000     -0.1590000    
 C   0.5326000      -1.500400      4.8700001E-02
 C   -1.796800       1.272000      0.9749000    
 C   -3.003100     -0.8312000     -0.5007000    
 C    2.779500      0.4608000      0.4078000    
 C   -3.154600       1.315500      0.6418000    
 C   -3.752100      0.2728000     -9.0200000E-02
 C    1.061700       1.087600      -1.240700    
 H   0.5641000     -0.3298000       1.844600    
 H    1.211400       1.850600      0.7013000    
 H  -0.9432000      -2.671800     -0.9819000    
 H   -1.342600       2.076300       1.542800    
 H   -3.460700      -1.636200      -1.064200    
 H   -3.757800       2.164300      0.9530000    
 H   -4.809000      0.3294000     -0.3367000    
 H    3.976900      6.2399998E-02   1.894000    


%chk=000041166-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041166

0 1
O 1.589670 -2.199636 -0.081471
O 3.034426 0.203361 1.760086
O 3.778086 0.428899 -0.437056
N -0.739546 -1.885484 -0.416116
N 0.924657 1.428317 -2.410210
C 0.384046 -0.147139 0.738231
C -1.084552 0.190763 0.545507
C 1.398259 0.898529 0.158519
C -1.709499 -0.886239 -0.141788
C 0.532995 -1.532020 0.045623
C -1.840035 1.307415 0.931818
C -3.079291 -0.875613 -0.455042
C 2.862164 0.473152 0.397969
C -3.225157 1.339582 0.622628
C -3.831255 0.259971 -0.061864
C 1.154038 1.188400 -1.266504
H 0.646787 -0.271919 1.805350
H 1.253259 1.837658 0.730801
H -0.913428 -2.749104 -0.930791
H -1.376254 2.146418 1.463434
H -3.555499 -1.706084 -0.986346
H -3.828249 2.205619 0.913270
H -4.900542 0.300276 -0.295945
H 3.964019 -0.109721 1.922897


