%chk=000021403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021403

0 1
 O    2.046500      0.3111000     -0.5536000    
 C  -0.3329000      0.1957000     -0.1543000    
 C   -1.471100     -0.6050000      0.1031000    
 C   0.9201000     -0.4205000     -0.3051000    
 C  -0.4814000       1.588700     -0.2534000    
 C   -1.322900      -1.998100      0.2018000    
 C    1.049200      -1.806000     -0.2034000    
 C   -2.724200      1.0900000E-02  0.2537000    
 C  -7.0299998E-02  -2.593400      4.9400002E-02
 C   -1.734000       2.183800     -0.1007000    
 C   -2.853300       1.396400      0.1524000    
 C    3.099000      0.2185000      0.4021000    
 C    3.875400       1.518100      0.4080000    
 H   0.3728000       2.232900     -0.4501000    
 H   -2.184300      -2.633200      0.3984000    
 H    2.014900      -2.288000     -0.3293000    
 H   -3.612800     -0.5850000      0.4519000    
 H   3.0099999E-02  -3.672100      0.1258000    
 H   -1.835200       3.262300     -0.1795000    
 H   -3.828200       1.860300      0.2712000    
 H    2.703100      3.1599998E-02   1.408200    
 H    3.762600     -0.6076000      0.1241000    
 H    4.700900       1.477400       1.124200    
 H    4.280900       1.729800     -0.5869000    
 H    3.221100       2.356200      0.6700000    


%chk=000021403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021403

0 1
O 1.913351 0.672328 0.173766
C -0.452395 0.292444 0.065376
C -1.585199 -0.608186 0.053222
C 0.874642 -0.269279 0.168110
C -0.672541 1.704111 -0.023798
C -1.366187 -2.024512 0.142378
C 1.063539 -1.655235 0.253951
C -2.902785 -0.050407 -0.048731
C -0.069677 -2.527667 0.240137
C -1.970424 2.214883 -0.122302
C -3.094727 1.330861 -0.134920
C 3.299081 0.175516 0.276986
C 4.209680 1.400759 0.264467
H 0.194916 2.369945 -0.012975
H -2.228624 -2.700421 0.132603
H 2.065456 -2.086317 0.331752
H -3.762463 -0.731256 -0.058205
H 0.097062 -3.608511 0.307736
H -2.130306 3.296676 -0.190049
H -4.107638 1.741726 -0.212359
H 3.412123 -0.403015 1.216869
H 3.513362 -0.496151 -0.579619
H 5.267521 1.088077 0.333237
H 4.074443 1.975775 -0.667417
H 3.983789 2.062656 1.117785


