%chk=000031258.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031258

0 1
 O    2.363400      -1.259300      0.5126000    
 C   0.7150000      0.4199000     -0.1391000    
 C  -0.6187000      0.6843000     -0.9027000    
 C   -1.919300       0.000000     -0.4213000    
 C    1.090000      -1.074800     -9.3000002E-02
 C   0.6748000      0.9782000       1.295400    
 C    1.828800       1.191700     -0.8900000    
 C   -1.823200      -1.518900     -0.3079000    
 C   -2.310700      0.5788000      0.9459000    
 H  -0.7960000       1.768200     -0.9471000    
 H  -0.4701000      0.3739000      -1.947200    
 H   -2.704300      0.2528000      -1.145400    
 H   0.4254000      -1.652600      0.5383000    
 H    1.122000      -1.508500      -1.097700    
 H   0.1869000       1.957500       1.336600    
 H   0.1862000      0.2979000       1.995600    
 H    1.689400       1.118000       1.689400    
 H    1.596600       2.261600     -0.9459000    
 H    1.939700      0.8205000      -1.915200    
 H    2.802400       1.095400     -0.3969000    
 H   -1.482900      -1.869300      0.6688000    
 H   -2.834300      -1.935100     -0.4095000    
 H   -1.235900      -1.960800      -1.117400    
 H   -3.379700      0.3946000       1.111900    
 H   -1.802700      0.1052000       1.786500    
 H   -2.171800       1.663300      0.9903000    
 H    2.553700      -2.212900      0.4971000    


%chk=000031258-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000031258

0 1
O 2.428456 -1.094726 0.754244
C 0.771248 0.503652 -0.073756
C -0.603967 0.687852 -0.810469
C -1.931481 -0.012097 -0.365783
C 1.055391 -0.986210 0.224796
C 0.845550 1.321392 1.245444
C 1.871979 1.038155 -1.035718
C -2.022625 -1.509715 -0.761561
C -2.323987 0.187005 1.118577
H -0.793291 1.782223 -0.813457
H -0.448787 0.408831 -1.875002
H -2.712952 0.503761 -0.966730
H 0.331564 -1.367699 0.975189
H 0.953158 -1.581189 -0.708926
H 0.688684 2.397684 1.041884
H 0.087281 1.001584 1.979764
H 1.840163 1.194933 1.707185
H 1.663837 2.089793 -1.310015
H 1.909121 0.442501 -1.967947
H 2.864250 0.985192 -0.558220
H -1.362300 -2.146837 -0.146924
H -3.056443 -1.879610 -0.624007
H -1.748386 -1.659413 -1.822863
H -3.359529 -0.163926 1.289903
H -1.665801 -0.386624 1.796945
H -2.270897 1.251056 1.412607
H 2.614464 -2.037972 0.986939


