%chk=000021474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021474

0 1
 O    3.301700      -1.135600      0.6256000    
 O    2.251700      -1.146000      -1.422900    
 N   0.5087000      0.9611000     -0.1464000    
 N    1.221300       2.463000       1.267200    
 C  -0.4118000      0.2765000      -1.089800    
 C   -1.651800     -0.1899000     -0.4048000    
 C  -0.5942000       1.123400      -2.371800    
 C    1.741100      0.5428000      0.1808000    
 C   0.2146000       2.099100      0.5042000    
 C   -1.645100      -1.387400      0.3104000    
 C   -2.818200      0.5717000     -0.4790000    
 C    2.176400       1.497400       1.069800    
 C   -2.804700      -1.823600      0.9513000    
 C   -3.977800      0.1355000      0.1621000    
 C    2.416200     -0.6203000     -0.2965000    
 C   -3.970900      -1.062200      0.8772000    
 C    4.042800      -2.305400      0.2624000    
 H   8.4500000E-02 -0.6324000      -1.435200    
 H   -1.012000       2.113700      -2.162000    
 H   -1.255500      0.6167000      -3.083000    
 H   0.3732000       1.281300      -2.862600    
 H  -0.7184000       2.637200      0.4059000    
 H  -0.7433000      -1.990400      0.3785000    
 H   -2.855800       1.513300      -1.017500    
 H    3.128000       1.545300       1.580200    
 H   -2.799300      -2.755700       1.508800    
 H   -4.885500      0.7293000      0.1069000    
 H   -4.873600      -1.401400       1.377000    
 H    4.666400      -2.098200     -0.6122000    
 H    3.359300      -3.135400      6.1400000E-02
 H    4.688900      -2.574500       1.101900    


%chk=000021474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021474

0 1
O 3.916693 -0.716608 0.147563
O 2.189253 -1.493738 -1.220303
N 0.422313 0.506341 0.203686
N 1.091876 1.925470 1.856530
C -0.452570 -0.110318 -0.853884
C -1.891925 -0.221370 -0.337695
C -0.278932 0.662546 -2.177187
C 1.801438 0.273394 0.415568
C 0.053830 1.504880 1.086453
C -2.175107 -1.150505 0.698198
C -2.951628 0.559842 -0.858508
C 2.177240 1.162804 1.443096
C -3.483937 -1.293353 1.203920
C -4.266248 0.417853 -0.355388
C 2.592511 -0.718582 -0.306724
C -4.536499 -0.506489 0.677703
C 4.813625 -1.689840 -0.516776
H -0.046857 -1.125879 -1.006924
H -0.563093 1.724720 -2.072818
H -0.896539 0.204950 -2.969614
H 0.774698 0.613640 -2.498027
H -0.963323 1.880968 1.154559
H -1.362190 -1.762502 1.108427
H -2.761160 1.277364 -1.663237
H 3.163513 1.271953 1.886480
H -3.685219 -2.015766 2.002584
H -5.076133 1.028029 -0.770548
H -5.554596 -0.616409 1.067302
H 4.867998 -1.486341 -1.599602
H 4.447889 -2.718875 -0.361368
H 5.789982 -1.539281 -0.035565


