%chk=000093958.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093958

0 1
 O   -1.271900     -0.2948000      0.1981000    
 O  -0.4212000      0.5955000      -1.750800    
 C   0.5485000       1.227400      0.3736000    
 C    2.004100      0.8239000      7.5900003E-02
 C    2.260100     -0.6708000      0.2995000    
 C   0.3708000       2.749800      0.2446000    
 C    3.718400      -1.031600      1.4800000E-02
 C  -0.4237000      0.4852000     -0.5304000    
 C   -1.045300       3.208100      0.5686000    
 C    3.969300      -2.520200      0.1958000    
 C   -2.232000      -1.037700     -0.5593000    
 C   -3.075000      -1.832200      0.3821000    
 C   -4.402100      -1.702900      0.4875000    
 H   0.3273000      0.9508000       1.413600    
 H    2.253800       1.079700     -0.9619000    
 H    2.678900       1.403100      0.7188000    
 H    2.010300     -0.9359000       1.334000    
 H    1.610800      -1.266100     -0.3530000    
 H    1.068600       3.256900      0.9220000    
 H   0.6200000       3.073600     -0.7735000    
 H    4.378700     -0.4699000      0.6857000    
 H    3.979300     -0.7468000      -1.011100    
 H   -1.341500       2.886100       1.571900    
 H   -1.102400       4.300900      0.5336000    
 H   -1.771600       2.815500     -0.1495000    
 H    3.348400      -3.108900     -0.4871000    
 H    3.745900      -2.833700       1.220600    
 H    5.018100      -2.755600     -1.0600000E-02
 H   -2.840600     -0.3453000      -1.153000    
 H   -1.708400      -1.723000      -1.235700    
 H   -2.570300      -2.559700       1.012500    
 H   -4.959000      -2.312300       1.190900    
 H   -4.953500     -0.9933000     -0.1194000    


%chk=000093958-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093958

0 1
O -1.564697 0.260281 0.494899
O -0.735429 0.682065 -1.644168
C 0.519276 1.478694 0.334824
C 1.860084 0.758921 0.012918
C 1.929152 -0.701895 0.511020
C 0.570937 2.976453 -0.083288
C 3.293096 -1.367463 0.217991
C -0.622447 0.784184 -0.398860
C -0.691968 3.776042 0.300126
C 3.364514 -2.829444 0.708806
C -2.745575 -0.441172 -0.124979
C -2.414164 -1.871482 -0.463070
C -2.993114 -2.939323 0.139664
H 0.315378 1.407704 1.419865
H 2.022920 0.789006 -1.082926
H 2.679427 1.343835 0.478018
H 1.731832 -0.732168 1.602626
H 1.125484 -1.300207 0.034810
H 1.459169 3.429925 0.399063
H 0.733328 3.029936 -1.177309
H 4.099376 -0.774757 0.697093
H 3.487660 -1.332194 -0.873277
H -0.883052 3.726291 1.388288
H -0.582407 4.840091 0.022220
H -1.588137 3.387801 -0.218102
H 2.589371 -3.449047 0.219582
H 3.199310 -2.889605 1.801260
H 4.348401 -3.283502 0.489709
H -3.527944 -0.369062 0.646233
H -3.032104 0.123759 -1.031215
H -1.673494 -2.014055 -1.260977
H -2.744785 -3.966370 -0.149720
H -3.736598 -2.817444 0.937678


