%chk=000178769.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178769

0 1
 O   0.8781000     -0.8043000      -1.047800    
 O   -4.328100     -0.8881000      -1.122700    
 O    2.425500       2.090300     -0.4527000    
 O    3.919300     -0.7194000      -1.651700    
 C  -0.9488000     -0.2693000      0.5888000    
 C   0.4028000     -0.9149000      0.3019000    
 C    1.587200     -6.3299999E-02 -4.1299999E-02
 C   -2.052800     -0.9822000     -0.2790000    
 C  -0.9759000       1.240800      0.2903000    
 C   -3.431400     -0.2858000     -0.1894000    
 C   -1.209200     -0.4465000       2.107300    
 C   -2.326300       1.913500      0.3781000    
 C    1.453500       1.391800     -0.1950000    
 C   -3.337700       1.204900     -0.5094000    
 C   0.1012000       1.970800     -4.7499999E-02
 C    2.878200     -0.4966000      0.4818000    
 C   -2.210700      -2.481300      3.6699999E-02
 C    4.013100     -0.8091000     -0.4329000    
 C    3.162100     -0.6512000       1.784500    
 H   0.5481000      -1.873600      0.7842000    
 H   -1.738800     -0.9361000      -1.333000    
 H   -3.860700     -0.4268000      0.8094000    
 H   -1.113300      -1.493800       2.415100    
 H  -0.4752000      0.1179000       2.696400    
 H   -2.204700     -0.1080000       2.409500    
 H   -2.672700       1.913300       1.418000    
 H   -2.270100       2.966500      7.5999998E-02
 H   -4.324400       1.670200     -0.3933000    
 H   -3.072800       1.339200      -1.567000    
 H   2.0500001E-02   3.036300     -0.2392000    
 H   -2.898200      -2.957600     -0.6707000    
 H   -1.260000      -3.015400     -4.4100001E-02
 H   -2.612900      -2.641800       1.041800    
 H   -5.189800     -0.4474000      -1.027900    
 H    4.954500      -1.129100      4.5000002E-02
 H    2.410000     -0.4485000       2.541100    
 H    4.134300     -0.9759000       2.140600    


%chk=000178769-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178769

0 1
O 0.876163 -0.759105 -1.003015
O -4.300987 -1.118666 -1.109891
O 2.504135 2.206421 0.219650
O 3.872507 0.013629 -1.744484
C -1.006962 -0.189714 0.657660
C 0.355893 -0.839747 0.399629
C 1.612769 -0.047824 0.130996
C -2.076025 -1.005717 -0.186403
C -1.021475 1.287902 0.235859
C -3.456371 -0.307608 -0.210376
C -1.271354 -0.262625 2.196023
C -2.381623 1.955649 0.172796
C 1.482613 1.464996 0.100933
C -3.357726 1.143166 -0.713644
C 0.117965 2.005213 -0.012806
C 2.971401 -0.604131 0.437232
C -2.222518 -2.480298 0.253005
C 4.039301 -0.471194 -0.600493
C 3.275859 -1.215379 1.615245
H 0.492524 -1.830925 0.853757
H -1.708988 -0.996391 -1.233347
H -3.899641 -0.311191 0.812573
H -1.185400 -1.301669 2.560413
H -0.537332 0.356259 2.742753
H -2.280255 0.100562 2.456489
H -2.809046 2.028911 1.195341
H -2.283035 2.988239 -0.205525
H -4.356433 1.624491 -0.702667
H -3.002330 1.131063 -1.761495
H 0.059669 3.075024 -0.248296
H -2.959740 -2.971563 -0.402013
H -1.270859 -3.033035 0.166784
H -2.587375 -2.570942 1.293025
H -5.178024 -0.670410 -1.216195
H 5.036940 -0.863644 -0.272090
H 2.542825 -1.342247 2.419518
H 4.286834 -1.598000 1.804962


