%chk=000078316.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078316

0 1
 O    1.892100       1.451000     -0.8501000    
 N    1.070100     -0.5717000      5.8699999E-02
 N    3.315900      0.2396000      0.4127000    
 C  -0.2879000     -0.2515000      5.0200000E-02
 C  -0.7084000       1.015600      0.4538000    
 C   -1.224900      -1.198600     -0.3628000    
 C    1.523900      -1.976600      0.2922000    
 C   -2.066000       1.335900      0.4443000    
 C   -2.582500     -0.8783000     -0.3725000    
 C    2.070800      0.4456000     -0.1578000    
 C   -3.003000      0.3889000      3.1199999E-02
 H  -1.1100000E-02   1.768600      0.8104000    
 H  -0.9408000      -2.191300     -0.6967000    
 H    1.143500      -2.616200     -0.5089000    
 H    1.141500      -2.310500       1.261000    
 H    2.610200      -2.075100      0.2758000    
 H   -2.394500       2.320200      0.7650000    
 H   -3.312500      -1.614400     -0.6965000    
 H   -4.060200      0.6379000      2.4700001E-02
 H    3.493000     -0.4820000       1.102300    
 H    4.067900      0.9032000      0.2581000    


%chk=000078316-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078316

0 1
O 1.886494 1.702340 0.707619
N 1.133943 -0.461962 0.075683
N 3.383685 -0.061125 0.730909
C -0.274840 -0.157374 0.068077
C -0.766276 1.163754 -0.127213
C -1.207936 -1.218461 0.240168
C 1.552333 -1.818986 -0.332372
C -2.157184 1.399030 -0.154298
C -2.596340 -0.968319 0.201244
C 2.106276 0.468041 0.516980
C -3.083266 0.342348 0.002167
H -0.058977 1.986399 -0.234930
H -0.859923 -2.238754 0.431121
H 0.818215 -2.226536 -1.044771
H 1.634971 -2.525188 0.519942
H 2.522109 -1.767217 -0.855915
H -2.516721 2.423036 -0.307157
H -3.295037 -1.801429 0.339084
H -4.160759 0.536823 -0.026220
H 3.591210 -1.052116 0.822251
H 4.085122 0.615996 1.022730


