%chk=000036563.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036563

1 1
 O  -0.4021000      -1.608600     -0.7093000    
 O    3.129100      0.3838000      0.6330000    
 O    1.876000     -8.5299999E-02  -1.246200    
 N   -2.302500      0.4351000      1.9500000E-02
 C  -0.8618000      0.4979000      0.3715000    
 C  -0.2758000     -0.9049000      0.5269000    
 C   -2.509900     -0.3353000      -1.291800    
 C   -3.101900     -0.2739000       1.121200    
 C   -2.882000       1.845100     -0.1588000    
 C    1.197300     -0.9078000      0.9452000    
 C    2.079000     -0.1716000     -4.3000001E-02
 C    4.054600       1.125600     -0.1681000    
 H  -0.7624000       1.067500       1.303300    
 H  -0.3650000       1.055600     -0.4305000    
 H  -0.8119000      -1.477700       1.288800    
 H   -2.552500      -1.411000      -1.105300    
 H   -3.492100     -5.1399998E-02  -1.687500    
 H   -1.745500     -3.4600001E-02  -2.014300    
 H   -2.860500      0.1961000       2.079000    
 H   -4.166800     -0.1507000      0.8990000    
 H   -2.866200      -1.340300       1.131400    
 H   -2.342700       2.333100     -0.9759000    
 H   -3.947100       1.763700     -0.3945000    
 H   -2.738500       2.391600      0.7779000    
 H    1.578500      -1.933000       1.011200    
 H    1.287100     -0.4359000       1.930500    
 H  -5.4000001E-02  -2.506300     -0.5740000    
 H    3.548800       1.968900     -0.6478000    
 H    4.514800      0.4735000     -0.9166000    
 H    4.837800       1.513500      0.4886000    


%chk=000036563-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036563

1 1
O -0.230005 -1.568600 -0.128881
O 3.284181 -0.214425 0.239671
O 1.657573 1.265098 -0.523274
N -2.426757 0.351555 -0.075169
C -1.033161 0.626411 0.542521
C -0.232883 -0.614154 0.988179
C -2.283574 -0.033243 -1.554984
C -3.173044 -0.753895 0.666534
C -3.232168 1.648978 0.013068
C 1.202737 -0.213904 1.413094
C 2.036986 0.369345 0.271704
C 4.241669 0.304236 -0.782450
H -1.200857 1.264506 1.428059
H -0.454095 1.195653 -0.204129
H -0.719086 -1.081097 1.871432
H -1.612947 -0.899938 -1.619745
H -3.284107 -0.266337 -1.951670
H -1.850497 0.821009 -2.097538
H -3.212144 -0.511147 1.739847
H -4.196230 -0.816133 0.264845
H -2.647649 -1.705096 0.501310
H -2.643628 2.465955 -0.431385
H -4.174422 1.524343 -0.541991
H -3.447308 1.873519 1.069075
H 1.726392 -1.090489 1.831916
H 1.151697 0.541133 2.222098
H 0.408556 -2.305543 0.043634
H 4.427768 1.375909 -0.607077
H 3.826418 0.158559 -1.792561
H 5.152386 -0.289509 -0.632732


