%chk=000115502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115502

0 1
 O    3.089000      0.3817000      8.2300000E-02
 O    2.728900      -1.851500     -0.2491000    
 N   -1.828700      0.1879000      3.6400001E-02
 N   0.9495000     -0.4489000      0.2659000    
 C   -3.050100      0.5864000     -0.6621000    
 C   -1.305800      -1.071100     -0.5154000    
 C  -0.8143000       1.249200     -5.1100001E-02
 C  -5.0700001E-02  -1.512700      0.2366000    
 C   0.4545000      0.8568000      0.7073000    
 C   -4.126000     -0.4954000     -0.5087000    
 C   -3.528100       1.916100     -8.7899998E-02
 C   -4.503200     -0.7466000      0.9458000    
 C    2.293700     -0.7311000      1.0700000E-02
 C    4.484800      0.1769000     -0.1651000    
 C    5.206500       1.502300     -4.5600001E-02
 H   -2.860600      0.7239000      -1.735500    
 H   -1.075700     -0.9612000      -1.583400    
 H   -2.010300      -1.899500     -0.4073000    
 H   -1.146700       2.183200      0.4114000    
 H  -0.5644000       1.461500      -1.099200    
 H  -0.2915000      -1.758900       1.278200    
 H   0.3632000      -2.414800     -0.2260000    
 H    1.214400       1.633000      0.5791000    
 H   0.2501000      0.7747000       1.781900    
 H   -3.862600      -1.434300      -1.004700    
 H   -5.030800     -0.1571000      -1.032200    
 H   -4.570400       2.103700     -0.3728000    
 H   -3.481700       1.951600       1.006800    
 H   -2.958700       2.763200     -0.4863000    
 H   -4.918700      0.1454000       1.423300    
 H   -5.273900      -1.523700      0.9936000    
 H   -3.652400      -1.096200       1.538200    
 H    4.885500     -0.5302000      0.5697000    
 H    4.620800     -0.2288000      -1.173800    
 H    6.277900       1.382400     -0.2290000    
 H    4.803600       2.226200     -0.7617000    
 H    5.064000       1.929800      0.9524000    


%chk=000115502-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115502

0 1
O 3.105151 0.399241 0.131826
O 2.722348 -1.873184 -0.346971
N -1.812381 0.205758 0.026015
N 0.980778 -0.464908 0.359263
C -3.082074 0.612392 -0.666888
C -1.260814 -1.075661 -0.494230
C -0.756885 1.254485 -0.027124
C -0.038554 -1.527940 0.326197
C 0.477251 0.846942 0.801618
C -4.190307 -0.469951 -0.513383
C -3.592299 1.976913 -0.145055
C -4.548660 -0.816975 0.948018
C 2.286160 -0.746477 0.021767
C 4.534925 0.173980 -0.215784
C 5.234508 1.523379 -0.078603
H -2.886894 0.721044 -1.768570
H -0.967209 -0.985664 -1.571817
H -2.028044 -1.863495 -0.417443
H -1.151847 2.192649 0.395522
H -0.436906 1.458041 -1.082430
H -0.363303 -1.755126 1.362202
H 0.417157 -2.430977 -0.110790
H 1.276726 1.594499 0.697997
H 0.182638 0.781785 1.869304
H -3.899945 -1.392536 -1.051728
H -5.088825 -0.091918 -1.039902
H -4.623923 2.147138 -0.501781
H -3.601035 1.994089 0.959293
H -2.980721 2.823212 -0.502534
H -4.960465 0.057907 1.482353
H -5.306470 -1.620944 0.985935
H -3.653099 -1.150140 1.501056
H 4.949937 -0.586789 0.470191
H 4.591240 -0.227264 -1.243878
H 6.306966 1.415056 -0.323704
H 4.794787 2.266926 -0.765639
H 5.151190 1.908412 0.952396


