%chk=000044281.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044281

0 1
 O   -2.521100      -2.164600     -0.3431000    
 C   0.1607000     -0.5334000      0.3699000    
 C    1.011100      0.5462000      2.6500000E-02
 C   -1.228300     -0.3452000      0.4783000    
 C   -1.822100      0.9040000      0.2534000    
 C    2.430200      0.3176000     -7.5800002E-02
 C   -1.002600       1.994600     -8.9100003E-02
 C   0.3879000       1.800800     -0.1962000    
 C    2.941900     -0.9833000      0.1699000    
 C   -2.111000      -1.509800      0.8452000    
 C   0.7019000      -1.800200      0.6045000    
 C    2.071300      -2.022100      0.5061000    
 C   -3.210900       1.090500      0.3621000    
 C   -1.592300       3.250200     -0.3159000    
 C    3.376300       1.318600     -0.4116000    
 C    4.320700      -1.239700      7.8400001E-02
 C   -3.781200       2.342600      0.1340000    
 C   -2.972300       3.422100     -0.2049000    
 C    4.745200       1.050400     -0.4993000    
 C    5.217500     -0.2293000     -0.2541000    
 C   -3.361100      -3.278900     -6.6100001E-02
 C   -3.761800      -3.931000      -1.372300    
 H   0.9925000       2.666100     -0.4630000    
 H   -1.625400      -2.212000       1.530200    
 H   -2.981500      -1.204200       1.434400    
 H   0.1137000      -2.681200      0.8358000    
 H    2.450000      -3.026100      0.6895000    
 H   -3.909800      0.2935000      0.5906000    
 H  -0.9785000       4.108300     -0.5826000    
 H    3.066000       2.340300     -0.6146000    
 H    4.711400      -2.238200      0.2671000    
 H   -4.856500       2.473500      0.2137000    
 H   -3.414000       4.397800     -0.3847000    
 H    5.437400       1.846000     -0.7596000    
 H    6.279900     -0.4428000     -0.3209000    
 H   -2.823200      -4.001900      0.5572000    
 H   -4.256700      -2.943400      0.4686000    
 H   -4.410000      -4.793900      -1.195900    
 H   -4.289900      -3.217300      -2.013200    
 H   -2.876500      -4.261000      -1.925700    


%chk=000044281-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044281

0 1
O -2.521757 -2.306859 -0.324696
C 0.080805 -0.544619 0.312296
C 0.980293 0.567764 0.033250
C -1.321291 -0.326369 0.455298
C -1.873708 0.979740 0.243810
C 2.430242 0.324330 -0.072516
C -0.972473 2.085668 -0.043765
C 0.424420 1.850986 -0.124952
C 2.930963 -1.016843 0.075598
C -2.214727 -1.479902 0.862378
C 0.645824 -1.878312 0.425756
C 2.000790 -2.101447 0.313866
C -3.287111 1.262125 0.283387
C -1.508607 3.405758 -0.243432
C 3.375722 1.365046 -0.316121
C 4.331554 -1.271014 -0.023567
C -3.775613 2.550480 0.075813
C -2.878799 3.640173 -0.182333
C 4.751310 1.099134 -0.409023
C 5.237874 -0.229138 -0.262424
C -3.378520 -3.454715 0.018331
C -3.637127 -4.232860 -1.271280
H 1.068472 2.712428 -0.330029
H -1.714754 -2.110090 1.629678
H -3.159442 -1.117086 1.314418
H -0.030506 -2.726134 0.559825
H 2.402254 -3.119091 0.391740
H -3.997603 0.447519 0.451102
H -0.812682 4.227244 -0.451907
H 3.036498 2.398703 -0.432965
H 4.689965 -2.301129 0.090136
H -4.855166 2.736082 0.101343
H -3.278676 4.647898 -0.338278
H 5.452663 1.919969 -0.595096
H 6.311557 -0.432814 -0.336421
H -2.868399 -4.092259 0.776408
H -4.332167 -3.093398 0.465993
H -4.276026 -5.112852 -1.072799
H -4.141883 -3.590572 -2.013170
H -2.685269 -4.579942 -1.708851


