%chk=000138798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138798

0 1
 O   -1.265000     -0.2053000      0.1179000    
 O  -0.6055000      -2.266700     -0.6667000    
 C   -3.529700      0.5793000      0.4394000    
 C   -2.631300     -0.5775000     -6.8999999E-03
 C   -3.308100       1.822500     -0.4247000    
 C   -4.997600      0.1599000      0.3992000    
 C    1.030700     -0.6383000     -6.9700003E-02
 C  -0.3526000      -1.147800     -0.2477000    
 C    2.566600       1.192300     -3.9400000E-02
 C    1.266800      0.7143000     -0.2073000    
 C    2.037500      -1.533700      0.2285000    
 C    3.601600      0.3072000      0.2626000    
 C    3.337000      -1.055800      0.3963000    
 C    2.849800       2.649700     -0.1815000    
 H   -3.267400      0.8463000       1.471000    
 H   -2.820600      -1.455500      0.6226000    
 H   -2.843400     -0.8414000      -1.050500    
 H   -3.958000       2.641700     -9.8800004E-02
 H   -3.525500       1.617000      -1.478400    
 H   -2.273800       2.174500     -0.3543000    
 H   -5.644100      0.9725000      0.7471000    
 H   -5.172600     -0.7059000       1.046600    
 H   -5.307500     -0.1081000     -0.6166000    
 H   0.4730000       1.412700     -0.4573000    
 H    1.843400      -2.596500      0.3386000    
 H    4.618700      0.6665000      0.3944000    
 H    4.142800      -1.744800      0.6317000    
 H    3.726900       2.943500      0.4050000    
 H    3.034000       2.895700      -1.231900    
 H    2.007900       3.250400      0.1790000    


%chk=000138798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138798

0 1
O -1.300747 -0.126519 0.180056
O -0.667336 -2.354474 -0.066142
C -3.600346 0.692033 0.284213
C -2.725164 -0.565985 0.204048
C -3.425300 1.584374 -0.965415
C -5.076982 0.269286 0.475515
C 1.046175 -0.615374 0.030569
C -0.350243 -1.142297 0.039635
C 2.666600 1.237697 0.158080
C 1.331547 0.766556 0.170228
C 2.104632 -1.547872 -0.119419
C 3.714228 0.290892 0.010008
C 3.436570 -1.089235 -0.128677
C 2.968216 2.721642 0.278995
H -3.279367 1.266375 1.176730
H -2.869067 -1.227682 1.078554
H -2.929164 -1.153292 -0.711720
H -4.020113 2.511498 -0.872467
H -3.765593 1.053291 -1.875551
H -2.366909 1.863464 -1.107906
H -5.726775 1.159046 0.557533
H -5.214206 -0.336795 1.390588
H -5.433077 -0.327548 -0.386150
H 0.499882 1.467994 0.291039
H 1.861405 -2.610309 -0.222200
H 4.754806 0.638363 0.005101
H 4.260155 -1.802919 -0.239598
H 3.972691 2.898129 0.701884
H 2.936482 3.215215 -0.711810
H 2.230999 3.233148 0.922479


