%chk=000112040.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112040

0 1
 O   -3.310400     -0.5400000     -0.5774000    
 C   -2.534000      6.3400000E-02  0.4582000    
 C   -3.312800      0.8921000     -0.5127000    
 C   -1.052600     -3.3000000E-02  0.3282000    
 C  -0.4473000      -1.276400      0.1463000    
 C  -0.2711000       1.120800      0.3892000    
 C   0.9394000      -1.366000      2.5400000E-02
 C    1.115600       1.031300      0.2680000    
 C    1.720900     -0.2121000      8.6099997E-02
 C    3.167100     -0.3058000     -3.9700001E-02
 C    3.985100      0.6256000     -0.5716000    
 H   -2.936600     -7.3000002E-03   1.464200    
 H   -4.217400       1.373400     -0.1633000    
 H   -2.798400       1.423600      -1.303200    
 H   -1.045300      -2.182900      9.9500000E-02
 H  -0.7303000       2.094800      0.5370000    
 H    1.394400      -2.343300     -0.1166000    
 H    1.696100       1.947900      0.3345000    
 H    3.617000      -1.233000      0.3088000    
 H    5.052900      0.4394000     -0.6246000    
 H    3.622000       1.566200     -0.9698000    


%chk=000112040-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000112040

0 1
O -3.400482 -0.699429 0.679650
C -2.520018 0.524270 0.513392
C -3.535322 0.167927 -0.541557
C -1.058669 0.285340 0.318406
C -0.568664 -0.968602 -0.124424
C -0.131463 1.331605 0.567627
C 0.811088 -1.159089 -0.328530
C 1.246548 1.139609 0.358877
C 1.748318 -0.111640 -0.099321
C 3.183677 -0.375025 -0.334665
C 4.220492 0.495964 -0.187526
H -2.782556 1.339403 1.201581
H -4.471984 0.735886 -0.607532
H -3.179865 -0.289034 -1.474013
H -1.276187 -1.791885 -0.272617
H -0.495149 2.302940 0.926008
H 1.178620 -2.136465 -0.665535
H 1.938674 1.964825 0.559026
H 3.416374 -1.397662 -0.667445
H 5.250241 0.186275 -0.392687
H 4.080630 1.533488 0.137784


