%chk=000107519.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107519

0 1
 O  -0.8284000     -0.1381000      0.6041000    
 O   0.4638000      -2.157900     -0.8019000    
 O   -1.026900       1.077300      -1.376100    
 C    3.292100     -2.7899999E-02  0.1071000    
 C   0.5581000     -0.1087000      0.4319000    
 C    1.171700      -1.123100     -0.2691000    
 C    2.556200      -1.082300     -0.4337000    
 C    2.643400      0.9858000      0.8122000    
 C    1.259000      0.9451000      0.9769000    
 C    4.735800      1.4800000E-02 -6.4700000E-02
 C   -2.972400      0.4341000     -0.1573000    
 C   -1.541200      0.5062000     -0.4044000    
 C   -3.808400       1.461600     -0.5943000    
 C   -3.509200     -0.6625000      0.5171000    
 C    5.515900       1.113000      5.4699998E-02
 C   -5.181300       1.392600     -0.3569000    
 C   -4.882000     -0.7316000      0.7544000    
 C   -5.718000      0.2959000      0.3174000    
 C   0.2743000      -3.306000      2.2700001E-02
 C    6.997500       1.111600     -0.1400000    
 H    3.051100      -1.877300     -0.9876000    
 H    3.176800       1.815000       1.267600    
 H   0.7544000       1.731200       1.530000    
 H    5.210400     -0.9298000     -0.3229000    
 H   -3.406100       2.324600      -1.118600    
 H   -2.884800      -1.484500      0.8575000    
 H    5.088900       2.084500      0.2844000    
 H   -5.832200       2.192900     -0.6965000    
 H   -5.300700      -1.586900       1.276700    
 H   -6.787000      0.2417000      0.5017000    
 H    1.238300      -3.754500      0.2832000    
 H  -0.3121000      -4.038100     -0.5390000    
 H  -0.2751000      -3.040800      0.9315000    
 H    7.266900       1.789600     -0.9555000    
 H    7.493300       1.455900      0.7727000    
 H    7.382000      0.1160000     -0.3825000    


%chk=000107519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107519

0 1
O -0.756634 -0.257968 0.296252
O 0.892295 -2.478256 -0.774018
O -1.166550 1.713631 -0.923637
C 3.504365 0.023627 0.016747
C 0.665690 -0.150719 0.180797
C 1.406095 -1.263294 -0.302059
C 2.815313 -1.149971 -0.376628
C 2.734421 1.114658 0.517956
C 1.336968 1.020950 0.597911
C 4.976873 0.051565 -0.103075
C -3.030371 0.438547 0.004721
C -1.596923 0.737639 -0.274544
C -4.006296 1.279234 -0.593538
C -3.437916 -0.638175 0.835754
C 5.809424 1.080775 0.224755
C -5.376742 1.041590 -0.367164
C -4.811110 -0.868911 1.062287
C -5.781887 -0.032856 0.460898
C -0.387556 -3.003143 -0.268172
C 7.310955 1.049533 0.073413
H 3.364542 -2.018496 -0.756274
H 3.224571 2.037632 0.841696
H 0.746144 1.864194 0.966300
H 5.431606 -0.866326 -0.505254
H -3.668680 2.105729 -1.227608
H -2.679052 -1.271647 1.302636
H 5.387936 2.013889 0.627314
H -6.127624 1.689556 -0.831580
H -5.125910 -1.696657 1.706876
H -6.847568 -0.215931 0.638220
H -0.444032 -2.922852 0.832924
H -0.387617 -4.062061 -0.570663
H -1.245990 -2.478632 -0.719360
H 7.661012 1.853015 -0.604690
H 7.815402 1.216326 1.045850
H 7.658943 0.083208 -0.332242


