%chk=000112641.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112641

0 1
 O   -1.327800      0.3033000       1.448800    
 C  -0.3524000      0.9646000     -0.6368000    
 C   0.9803000       1.229900      8.5199997E-02
 C    1.774900     -3.9799999E-02  0.4609000    
 C   -1.345700      0.1811000      0.2219000    
 C  -0.9822000       2.270000      -1.119400    
 C    3.091100      0.3506000       1.140000    
 C   -2.335700     -0.7392000     -0.4776000    
 C    2.071500     -0.8945000     -0.7460000    
 C   -3.246000      -1.461300      0.5015000    
 C    1.672100      -2.164800     -0.8786000    
 H  -0.1523000      0.3558000      -1.526600    
 H   0.7932000       1.812800      0.9971000    
 H    1.606900       1.863300     -0.5580000    
 H    1.191300     -0.6186000       1.187700    
 H  -0.3055000       2.807900      -1.791100    
 H   -1.914700       2.080000      -1.661300    
 H   -1.221800       2.925900     -0.2752000    
 H    3.656500     -0.5385000       1.441100    
 H    3.727800      0.9453000      0.4751000    
 H    2.899800      0.9432000       2.041200    
 H   -2.939100     -0.1382000      -1.165000    
 H   -1.766900      -1.473100      -1.057600    
 H    2.646000     -0.4449000      -1.552400    
 H   -2.666000      -2.076600       1.197200    
 H   -3.940400      -2.114600     -3.5599999E-02
 H   -3.832800     -0.7495000       1.091500    
 H    1.917800      -2.727100      -1.772700    
 H    1.095900      -2.661800     -0.1062000    


%chk=000112641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000112641

0 1
O -1.408014 0.453519 1.512783
C -0.367204 0.950515 -0.644845
C 0.987566 1.214930 0.054019
C 1.793968 -0.066191 0.419879
C -1.349776 0.204681 0.277578
C -1.037741 2.287987 -1.076099
C 3.093784 0.326250 1.171610
C -2.261283 -0.829025 -0.385309
C 2.130310 -0.885002 -0.813873
C -3.371441 -1.372722 0.528712
C 1.782169 -2.179613 -1.026481
H -0.205360 0.331770 -1.549578
H 0.794094 1.784139 0.983781
H 1.607810 1.858334 -0.604135
H 1.174711 -0.684711 1.099810
H -0.381275 2.831686 -1.779507
H -2.009143 2.121497 -1.577641
H -1.210909 2.931156 -0.194507
H 3.660916 -0.570068 1.479450
H 3.752471 0.941007 0.528066
H 2.856603 0.916050 2.076457
H -2.679734 -0.382741 -1.311347
H -1.601006 -1.650510 -0.739649
H 2.722398 -0.356892 -1.581357
H -2.941862 -1.812957 1.444642
H -3.965335 -2.145672 0.009083
H -4.051900 -0.564064 0.847820
H 2.076906 -2.716089 -1.935834
H 1.204077 -2.746065 -0.284429


