%chk=000000803.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000803

0 1
 O    1.826400     -2.2200000E-02   1.418300    
 O    4.239700     -0.6546000       1.075600    
 O    4.038800     -0.3307000      -1.187000    
 N   -1.786000       2.005600      0.2093000    
 C  -7.6200001E-02  0.7690000     -0.4797000    
 C   -1.198500     -8.6300001E-02 -0.2963000    
 C   -2.257700      0.7143000      0.1363000    
 C    1.271500      0.3667000     -0.9307000    
 C  -0.4687000       2.048700     -0.1614000    
 C   -1.415500      -1.469300     -0.4572000    
 C   -3.528100      0.1991000      0.4174000    
 C   -2.681000      -1.998600     -0.1799000    
 C   -3.719800      -1.175500      0.2505000    
 C    2.164700     -1.2000001E-03  0.2439000    
 C    3.590400     -0.3650000     -5.9099998E-02
 H    1.214600     -0.4959000      -1.603400    
 H    1.745900       1.191200      -1.475400    
 H   6.9499999E-02   2.986400     -0.1640000    
 H   -2.333600       2.805500      0.4952000    
 H  -0.6168000      -2.125600     -0.7905000    
 H   -4.337300      0.8392000      0.7525000    
 H   -2.854100      -3.064600     -0.3019000    
 H   -4.694800      -1.607800      0.4603000    
 H    5.182900     -0.8741000      0.9188000    


%chk=000000803-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000803

0 1
O 1.797890 -0.107413 1.541396
O 4.329597 -0.967736 0.954549
O 3.914449 -0.604298 -1.305556
N -1.962978 2.102541 0.097747
C -0.084297 0.917403 -0.435294
C -1.180971 -0.016688 -0.243591
C -2.349341 0.756253 0.088534
C 1.331941 0.573274 -0.794032
C -0.601067 2.193642 -0.218245
C -1.292865 -1.429959 -0.324762
C -3.605872 0.161669 0.337552
C -2.542740 -2.029706 -0.079085
C -3.686854 -1.242729 0.248906
C 2.154364 -0.030135 0.347854
C 3.543197 -0.559057 -0.109732
H 1.387300 -0.130780 -1.648836
H 1.887375 1.466861 -1.146426
H -0.097695 3.158056 -0.260719
H -2.573995 2.890297 0.299767
H -0.421672 -2.049048 -0.568403
H -4.487272 0.761286 0.591384
H -2.643902 -3.119170 -0.135549
H -4.644898 -1.740028 0.437114
H 5.206604 -1.300234 0.617027


