%chk=000031465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031465

0 1
 O   -3.504000      0.9037000     -0.3143000    
 O   -2.726800      -1.324600     -4.5600001E-02
 C   -1.119000      0.4752000     -0.2701000    
 C   0.2370000       1.002400      0.1783000    
 C    1.363700      3.9299998E-02 -0.1952000    
 C   -2.244200       1.455800      6.8800002E-02
 C   -1.426200     -0.8892000      0.3513000    
 C    2.728300      0.5883000      0.2275000    
 C    3.857700     -0.3599000     -0.1817000    
 C   -3.719500     -0.3614000      0.3155000    
 C    5.248200      0.1543000      0.1971000    
 C   -5.067500     -0.8875000     -0.1472000    
 C    6.372300     -0.7963000     -0.1844000    
 H   -1.123500      0.3450000      -1.361300    
 H   0.2387000       1.165500       1.263500    
 H   0.4215000       1.977600     -0.2892000    
 H    1.230300     -0.9285000      0.2985000    
 H    1.355300     -0.1381000      -1.277400    
 H   -2.267300       1.692900       1.139500    
 H   -2.112000       2.396200     -0.4763000    
 H  -0.7334000      -1.658800      1.6000000E-03
 H   -1.374100     -0.8608000       1.446300    
 H    2.748000      0.7364000       1.313900    
 H    2.890900       1.568700     -0.2362000    
 H    3.821000     -0.5218000      -1.266200    
 H    3.696800      -1.337500      0.2896000    
 H   -3.739200     -0.2368000       1.406100    
 H    5.422000       1.121800     -0.2888000    
 H    5.287400      0.3306000       1.278600    
 H   -5.076100      -1.021600      -1.234900    
 H   -5.284600      -1.860600      0.3044000    
 H   -5.869100     -0.1855000      0.1025000    
 H    7.340300     -0.3784000      0.1089000    
 H    6.387800     -0.9678000      -1.265300    
 H    6.252300      -1.762800      0.3151000    


%chk=000031465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031465

0 1
O -3.573002 0.943542 -0.376365
O -2.930386 -1.360906 -0.017187
C -1.144513 0.363382 -0.273321
C 0.239490 0.853727 0.214993
C 1.423663 -0.048483 -0.204722
C -2.234186 1.417232 0.026989
C -1.568601 -0.964367 0.395943
C 2.794250 0.533509 0.208444
C 3.987298 -0.358585 -0.201668
C -3.896841 -0.309856 0.310148
C 5.357267 0.226514 0.211242
C -5.266913 -0.765585 -0.154632
C 6.545149 -0.669627 -0.200520
H -1.119197 0.200538 -1.368843
H 0.227747 0.952791 1.321553
H 0.414291 1.875135 -0.183946
H 1.311517 -1.056652 0.243486
H 1.401815 -0.191614 -1.305013
H -2.237691 1.657416 1.116213
H -2.070149 2.346621 -0.542972
H -0.925579 -1.807838 0.100063
H -1.533155 -0.852317 1.505465
H 2.811800 0.685618 1.308187
H 2.916467 1.539435 -0.245571
H 3.971854 -0.511387 -1.301174
H 3.868121 -1.364630 0.252739
H -3.844952 -0.122844 1.412652
H 5.475838 1.231383 -0.243619
H 5.371254 0.379869 1.309808
H -5.247050 -0.935581 -1.243547
H -5.543671 -1.706044 0.349862
H -6.019688 0.006819 0.074038
H 7.511617 -0.226914 0.103201
H 6.570027 -0.815391 -1.297035
H 6.469109 -1.669112 0.268009


