%chk=000138417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138417

0 1
 O   0.2733000      -2.360100     -0.8355000    
 O  -0.2352000       1.977100      0.7125000    
 O   -2.932500     -2.1000000E-02  -2.246000    
 O   -2.244900       1.824900      -1.128500    
 N  -0.4079000     -0.2341000     -8.4899999E-02
 C   -1.848200     -0.3819000     -0.1477000    
 C   -2.478700     -0.2393000       1.259000    
 C   0.4800000      -1.229600     -0.4350000    
 C   0.2261000      0.9175000      0.3312000    
 C   -1.931100      -1.207600       2.313700    
 C   -4.007600     -0.3262000       1.202800    
 C    1.811700     -0.6600000     -0.2335000    
 C    1.658200      0.6384000      0.2299000    
 C   -2.340100      0.6074000      -1.193700    
 C    3.055900      -1.221500     -0.4337000    
 C    2.741000       1.443700      0.5174000    
 C    4.168000     -0.4238000     -0.1495000    
 C    4.012100      0.8959000      0.3217000    
 H   -2.068000      -1.393400     -0.5140000    
 H   -2.262700      0.7708000       1.631300    
 H  -0.8568000      -1.065500       2.466500    
 H   -2.097600      -2.246700       2.011000    
 H   -2.422900      -1.052500       3.280000    
 H   -4.330100      -1.299800      0.8188000    
 H   -4.443100     -0.1951000       2.199300    
 H   -4.429200      0.4513000      0.5580000    
 H    3.176100      -2.235900     -0.7953000    
 H    2.621600       2.457900      0.8798000    
 H    5.168100     -0.8245000     -0.2925000    
 H    4.894400       1.493900      0.5352000    
 H   -3.255200      0.6176000      -2.917100    


%chk=000138417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138417

0 1
O 0.120762 -2.400293 -0.798706
O -0.274868 2.050457 0.676061
O -3.639859 1.043688 -1.236288
O -1.543797 1.122329 -2.211516
N -0.415406 -0.202804 -0.068546
C -1.871694 -0.306082 -0.209487
C -2.662202 -0.206182 1.143025
C 0.478037 -1.261485 -0.408516
C 0.276881 0.977612 0.328973
C -1.848272 -0.823495 2.304979
C -4.026456 -0.928529 1.019651
C 1.852141 -0.710187 -0.190116
C 1.731929 0.631666 0.248347
C -2.291124 0.690660 -1.310633
C 3.105672 -1.315846 -0.360873
C 2.862269 1.412366 0.530810
C 4.255869 -0.533891 -0.078082
C 4.135812 0.809283 0.360818
H -2.040688 -1.323924 -0.625230
H -2.835521 0.863492 1.361348
H -0.930217 -0.252334 2.525074
H -1.563714 -1.869915 2.084156
H -2.464410 -0.828598 3.222326
H -3.877399 -2.012829 0.849009
H -4.599467 -0.813288 1.957466
H -4.632252 -0.520615 0.195618
H 3.185462 -2.352446 -0.702531
H 2.758160 2.448791 0.866398
H 5.252313 -0.971382 -0.201382
H 5.041524 1.388610 0.569670
H -3.844783 1.673071 -1.980622


