%chk=000018986.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018986

0 1
 O    3.096800       1.742500     -4.6500001E-02
 O   -3.942300       1.791700      0.1087000    
 O   -2.706900      0.7063000      -1.456400    
 N  -0.2355000      -2.611000     -7.1000000E-03
 C   0.1585000     -0.4308000      0.2547000    
 C   -1.216100     -0.6897000      0.5162000    
 C   0.7509000      -1.652800     -7.1500003E-02
 C   -1.427600      -2.038600      0.3475000    
 C   -2.240200      0.3033000      0.8993000    
 C   0.9581000      0.7294000      0.2639000    
 C    2.108300      -1.772800     -0.3901000    
 C    2.317400      0.6244000     -5.2800000E-02
 C    2.881600     -0.6085000     -0.3744000    
 C   -2.963700      0.9333000     -0.2821000    
 C    2.460600       2.973300      0.2906000    
 H   -2.318100      -2.643800      0.4463000    
 H  -9.8499998E-02  -3.594500     -0.1947000    
 H   -1.785500       1.112200       1.482600    
 H   -2.997500     -0.1766000       1.531200    
 H   0.4684000       1.661100      0.5189000    
 H    2.548400      -2.732200     -0.6406000    
 H    3.939500     -0.6738000     -0.6183000    
 H    3.226300       3.754900      0.2467000    
 H    2.076800       2.961400       1.316500    
 H    1.689600       3.242200     -0.4395000    
 H   -4.403000       2.193900     -0.6583000    


%chk=000018986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018986

0 1
O 2.951694 1.868897 -0.079207
O -2.323294 2.120562 -0.279790
O -3.869329 0.530274 -0.968767
N -0.188084 -2.752270 -0.010963
C 0.055751 -0.496772 0.278234
C -1.319714 -0.858128 0.572598
C 0.743788 -1.705747 -0.079557
C -1.428142 -2.237658 0.380847
C -2.433735 0.070194 1.005145
C 0.758255 0.740609 0.289134
C 2.116449 -1.711840 -0.417722
C 2.126681 0.725278 -0.046568
C 2.800870 -0.486621 -0.395606
C -2.977115 0.878447 -0.167697
C 2.330156 3.145975 0.266691
H -2.299340 -2.880569 0.492229
H 0.008629 -3.730891 -0.206363
H -2.077615 0.769556 1.781870
H -3.275470 -0.512826 1.414739
H 0.229370 1.665845 0.532261
H 2.640872 -2.634385 -0.689495
H 3.863783 -0.426658 -0.647570
H 3.132856 3.893169 0.178277
H 1.939813 3.137526 1.303856
H 1.506528 3.397196 -0.430853
H -2.667358 2.595635 -1.084926


