%chk=000094593.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094593

0 1
 O   -1.546700      -1.336400      0.8318000    
 O   -3.819000      0.2500000      0.5661000    
 O    2.510100       2.682500      0.3688000    
 O   0.5205000       2.327600     -0.4884000    
 N   0.9304000     -0.4319000     -0.3551000    
 N    2.670600      -1.574400      0.3717000    
 N    1.612100       1.884400     -2.7500000E-02
 C  -0.3927000     -0.1666000     -0.9199000    
 C   -1.478100     -7.9999998E-02  0.1548000    
 C   -2.841100      0.2081000     -0.4674000    
 C    1.465300      -1.661700     -0.1457000    
 C    1.827500      0.5039000      4.4100001E-02
 C    2.902200     -0.2271000      0.4931000    
 C   0.7497000      -2.911500     -0.4740000    
 C   -5.110800      0.5332000      4.7699999E-02
 H  -0.3596000      0.6882000      -1.596600    
 H  -0.6203000      -1.007000      -1.585800    
 H   -1.249600      0.6827000      0.9081000    
 H   -3.111100     -0.5888000      -1.170700    
 H   -2.820400       1.167200     -0.9976000    
 H    3.834000      0.1419000      0.8979000    
 H  -3.4800000E-02  -3.140400      0.2488000    
 H   0.3284000      -2.902500      -1.482500    
 H    1.454500      -3.750800     -0.4431000    
 H  -0.8286000      -1.354000       1.487200    
 H   -5.819200      0.5521000      0.8802000    
 H   -5.421300     -0.2447000     -0.6566000    
 H   -5.122100       1.511700     -0.4420000    


%chk=000094593-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094593

0 1
O -1.709747 -1.541238 0.662165
O -3.754742 0.229085 0.613457
O 2.501623 2.749649 0.244754
O 0.377225 2.333762 -0.510976
N 0.956752 -0.494013 -0.437060
N 2.860910 -1.459739 0.361390
N 1.557338 1.936675 -0.108539
C -0.405628 -0.370620 -0.999405
C -1.477995 -0.207823 0.088929
C -2.789541 0.346902 -0.486260
C 1.619284 -1.687521 -0.169387
C 1.833540 0.539533 -0.038653
C 2.997551 -0.087276 0.442180
C 1.038683 -3.041287 -0.418613
C -5.105160 0.650456 0.240081
H -0.426111 0.495016 -1.677454
H -0.622078 -1.291017 -1.566799
H -1.120783 0.490110 0.872101
H -3.130848 -0.255119 -1.357982
H -2.662601 1.406457 -0.791428
H 3.889946 0.392909 0.834144
H 0.043554 -3.132532 0.050741
H 0.930489 -3.253216 -1.499838
H 1.722334 -3.789619 0.009194
H -2.538541 -1.467937 1.207260
H -5.731053 0.511626 1.134920
H -5.503665 0.034161 -0.592760
H -5.120836 1.718320 -0.058760


