%chk=000036571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036571

0 1
 O    3.385900     -4.1000001E-02  0.2545000    
 O   -2.595600     -0.6477000      -1.552800    
 N   -3.503900       1.404500      0.9971000    
 C  -0.7341000     -0.4356000     -5.9799999E-02
 C   -2.214300     -0.5770000     -0.1723000    
 C   1.8300001E-02  -1.439100      0.5503000    
 C  -0.1021000      0.7010000     -0.5643000    
 C    2.034800     -0.1695000      0.1517000    
 C    1.402800      -1.306000      0.6562000    
 C    1.282400      0.8340000     -0.4585000    
 C   -2.942000      0.5304000      0.4803000    
 C    3.967900       1.146000     -0.2821000    
 H   -2.536600      -1.520500      0.2846000    
 H  -0.4586000      -2.330800      0.9483000    
 H  -0.6721000       1.490000      -1.048200    
 H    1.983700      -2.091100       1.132300    
 H    1.709000       1.741100     -0.8728000    
 H   -3.550200     -0.8325000      -1.584500    
 H    3.615100       2.040200      0.2430000    
 H    3.817200       1.214100      -1.364900    
 H    5.047900       1.081400     -0.1132000    


%chk=000036571-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036571

0 1
O 3.433209 -0.100394 0.156758
O -2.615325 -1.041827 -1.444149
N -3.694655 1.622253 0.509370
C -0.784408 -0.391023 0.009602
C -2.287331 -0.584130 -0.069812
C 0.029217 -1.460110 0.465245
C -0.167062 0.809309 -0.408531
C 2.036050 -0.125077 0.079305
C 1.427518 -1.334745 0.502501
C 1.235834 0.953092 -0.377374
C -3.049567 0.650549 0.256215
C 4.118547 1.123351 -0.270792
H -2.595870 -1.358091 0.665901
H -0.435312 -2.400000 0.786256
H -0.784104 1.643659 -0.760957
H 2.067498 -2.150255 0.851265
H 1.687811 1.893803 -0.704252
H -3.594219 -1.206968 -1.507295
H 3.818689 1.989363 0.350360
H 3.920133 1.342685 -1.337635
H 5.188847 0.916456 -0.127080


