%chk=000011096.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011096

0 1
 O   -2.784000      0.2183000      3.0000001E-04
 N    1.228800     -0.8181000      9.9999997E-05
 C   0.6152000     -0.2455000       1.208600    
 C   0.6149000     -0.2460000      -1.208500    
 C   0.9661000       1.256300       1.261600    
 C   0.9659000       1.255900      -1.262100    
 C   0.5668000       2.019500     -3.0000001E-04
 C  -0.8988000     -0.4931000       1.292700    
 C  -0.8991000     -0.4937000      -1.292800    
 C   -1.617400     -0.1759000       0.000000    
 C    1.241500      -2.277600      3.0000001E-04
 H    1.078000     -0.6977000       2.096100    
 H    1.077700     -0.6984000      -2.095800    
 H    2.051600       1.357300       1.397800    
 H   0.5022000       1.725800       2.137300    
 H   0.5019000       1.725100      -2.137800    
 H    2.051400       1.356800      -1.398500    
 H  -0.5127000       2.204900     -1.9999999E-04
 H    1.041200       3.007800     -5.0000002E-04
 H   -1.336200      0.1145000       2.093100    
 H   -1.101700      -1.544500       1.526100    
 H   -1.102000      -1.545200      -1.525600    
 H   -1.336400      0.1136000      -2.093300    
 H   0.2427000      -2.724700      3.0000001E-04
 H    1.780000      -2.652800      0.8776000    
 H    1.780000      -2.653100     -0.8769000    


%chk=000011096-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011096

0 1
O -2.771447 0.499439 0.000071
N 1.208780 -0.834893 0.000066
C 0.615814 -0.235762 1.222516
C 0.615682 -0.236159 -1.222517
C 0.980736 1.269722 1.275312
C 0.980607 1.269301 -1.275849
C 0.539015 2.027399 -0.000372
C -0.939169 -0.486087 1.289182
C -0.939311 -0.486497 -1.288932
C -1.655251 -0.093243 0.000103
C 1.293265 -2.305385 0.000300
H 1.074238 -0.735665 2.097350
H 1.074007 -0.736356 -2.097234
H 2.080223 1.338929 1.380698
H 0.528728 1.730996 2.174230
H 0.528509 1.730281 -2.174874
H 2.080083 1.338470 -1.381373
H -0.557761 2.170247 -0.000344
H 0.977281 3.043270 -0.000559
H -1.405327 0.043033 2.138980
H -1.098699 -1.573836 1.446932
H -1.098874 -1.574293 -1.446330
H -1.405559 0.042363 -2.138843
H 0.308492 -2.836235 0.000436
H 1.851815 -2.639624 0.893176
H 1.851723 -2.639914 -0.892525


