%chk=000037489.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037489

0 1
 O    2.692900     -0.5099000     -0.4492000    
 O    1.440600       1.401700     -0.5394000    
 N   0.4618000     -0.7029000     -0.2027000    
 C    3.854700      0.1947000      4.3000001E-03
 C  -0.9019000     -0.4277000     -9.6299998E-02
 C    3.641300      0.6379000       1.443700    
 C    5.073000     -0.7051000     -0.1370000    
 C   -3.628700      0.1217000      0.1162000    
 C   -1.808600      -1.467000      0.1123000    
 C   -1.358600      0.8862000     -0.1987000    
 C   -3.172000      -1.192200      0.2185000    
 C   -2.722000       1.161000     -9.2399999E-02
 C    1.514000      0.1859000     -0.4090000    
 C   -5.086600      0.4157000      0.2298000    
 H    4.007200       1.072100     -0.6364000    
 H    4.554300       1.081800       1.854100    
 H    2.847300       1.384400       1.538800    
 H    3.355700     -0.2109000       2.075400    
 H    5.986700     -0.1936000      0.1803000    
 H    5.193200      -1.022800      -1.178300    
 H    4.955500      -1.617400      0.4581000    
 H   -1.466600      -2.495600      0.1944000    
 H  -0.7168000       1.741400     -0.3592000    
 H   0.7246000      -1.681900     -0.1181000    
 H   -3.868500      -2.010300      0.3829000    
 H   -3.066700       2.188800     -0.1717000    
 H   -5.361300       1.289400     -0.3710000    
 H   -5.688700     -0.4243000     -0.1329000    
 H   -5.350100      0.6109000       1.274000    


%chk=000037489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037489

0 1
O 2.657906 -0.573847 0.132843
O 1.441545 1.438506 -0.098881
N 0.405209 -0.684610 0.120981
C 3.946969 0.202247 0.114962
C -0.982337 -0.375408 0.062434
C 4.224727 0.745915 1.523638
C 5.001813 -0.783801 -0.391790
C -3.803357 0.099631 -0.037999
C -1.900484 -1.454018 0.156935
C -1.476596 0.946478 -0.086149
C -3.287905 -1.214138 0.105620
C -2.869849 1.162656 -0.135414
C 1.477082 0.189092 0.040162
C -5.299913 0.359413 -0.061138
H 3.807688 1.041246 -0.592079
H 5.182837 1.297640 1.533816
H 3.426320 1.439024 1.837499
H 4.292077 -0.081581 2.252235
H 5.982905 -0.280414 -0.462744
H 4.732494 -1.167838 -1.390494
H 5.099416 -1.640432 0.298411
H -1.528785 -2.481186 0.266095
H -0.774891 1.779311 -0.165443
H 0.662635 -1.668049 0.229238
H -3.979970 -2.061906 0.177468
H -3.238476 2.189073 -0.253887
H -5.547359 1.244858 -0.673174
H -5.855554 -0.502690 -0.471092
H -5.690448 0.546828 0.958446


