%chk=000022440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022440

0 1
 O    1.734500      -2.050300      0.9586000    
 O   0.6699000      -2.299200     -0.9534000    
 N    1.068100      -1.630700      6.5000001E-03
 C   -1.759200      4.0100001E-02 -0.1946000    
 C  -0.5429000      7.3799998E-02  0.7364000    
 C   -3.041700      0.3992000      0.5566000    
 C   0.7267000     -0.2430000      1.6000001E-02
 C   -4.246600      0.4082000     -0.3704000    
 C    1.623800      0.5476000     -0.5869000    
 C    1.540200       2.045000     -0.6758000    
 C    2.227200       2.709300      0.5070000    
 H   -1.866200     -0.9578000     -0.6374000    
 H   -1.612200      0.7440000      -1.023500    
 H  -0.4655000       1.071000       1.187600    
 H  -0.6939000     -0.6167000       1.576300    
 H   -3.213300     -0.3207000       1.365200    
 H   -2.938600       1.388000       1.018500    
 H    2.515300      0.1139000      -1.039100    
 H   -5.152200      0.6660000      0.1875000    
 H   -4.397300     -0.5752000     -0.8272000    
 H   -4.120200       1.143700      -1.171300    
 H   0.4950000       2.371400     -0.7223000    
 H    2.007900       2.372300      -1.611400    
 H    1.753900       2.429100       1.454000    
 H    2.171500       3.798400      0.4121000    
 H    3.284800       2.428800      0.5588000    


%chk=000022440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022440

0 1
O 0.102999 -2.486098 0.544734
O 2.090538 -2.059710 -0.479130
N 0.983927 -1.669879 0.062197
C -1.856218 0.014773 -0.175872
C -0.645367 0.135637 0.792471
C -3.194282 0.345661 0.522169
C 0.676138 -0.203680 0.147021
C -4.400163 0.254585 -0.437532
C 1.603873 0.640341 -0.387419
C 1.517369 2.143580 -0.438479
C 2.751533 2.816514 0.221778
H -1.896058 -1.015377 -0.578327
H -1.707505 0.695577 -1.038267
H -0.593485 1.167955 1.185426
H -0.813695 -0.537733 1.652015
H -3.341487 -0.350823 1.371947
H -3.141558 1.365135 0.957193
H 2.504005 0.181041 -0.820393
H -5.346851 0.494907 0.079886
H -4.494253 -0.763691 -0.858816
H -4.288580 0.958838 -1.283487
H 0.587480 2.512110 0.029431
H 1.479748 2.451550 -1.504361
H 2.810228 2.568239 1.296070
H 2.690482 3.914896 0.123405
H 3.690183 2.481852 -0.255857


