%chk=000075945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075945

0 1
 O   0.9349000      -1.001100      -1.789700    
 N    1.705400      0.2938000     -2.6000000E-03
 C    3.123200      0.1441000     -0.2987000    
 C    1.385900       1.107700       1.168400    
 C   0.7085000     -0.3057000     -0.7920000    
 C  -0.6879000     -0.1221000     -0.4203000    
 C   -1.327800      -1.011900      0.4426000    
 C    3.680500      -1.071800      0.4162000    
 C    1.223000       2.560800      0.7656000    
 C   -1.386300      0.9662000     -0.9435000    
 C   -2.666100     -0.8132000      0.7822000    
 C  -0.6039000      -2.186100       1.016600    
 C   -2.724700       1.164500     -0.6039000    
 C   -3.364500      0.2748000      0.2589000    
 H    3.244200      8.8999998E-03  -1.379100    
 H    3.663200       1.052900     -1.3700000E-02
 H   0.4706000      0.7583000       1.651900    
 H    2.187900       1.005800       1.908000    
 H    3.584800     -0.9749000       1.502500    
 H    3.152700      -1.983500      0.1165000    
 H    4.741100      -1.198900      0.1785000    
 H    2.150200       2.956600      0.3378000    
 H   0.4356000       2.711200      2.5900001E-02
 H   0.9772000       3.166900       1.643600    
 H  -0.9048000       1.659400      -1.628400    
 H   -3.180200      -1.496500       1.453200    
 H   0.2260000      -1.856500       1.649900    
 H   -1.260900      -2.805100       1.637400    
 H  -0.2169000      -2.827900      0.2181000    
 H   -3.269400       2.009900      -1.013800    
 H   -4.406700      0.4291000      0.5226000    


%chk=000075945-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000075945

0 1
O 1.052142 -1.425567 -1.306218
N 1.678908 0.403905 -0.012558
C 3.093869 0.169798 -0.398601
C 1.427898 1.377770 1.075473
C 0.721187 -0.462436 -0.536231
C -0.733122 -0.217676 -0.193737
C -1.500398 -1.243473 0.436973
C 3.783146 -0.890893 0.487254
C 1.571329 2.853186 0.643522
C -1.362436 0.980808 -0.615211
C -2.881689 -1.010773 0.652245
C -0.867475 -2.556783 0.860623
C -2.743562 1.187505 -0.408867
C -3.505203 0.187770 0.235744
H 3.100541 -0.169416 -1.447940
H 3.628475 1.135394 -0.339938
H 0.415329 1.202254 1.473697
H 2.141258 1.165504 1.898022
H 3.764712 -0.604883 1.555238
H 3.276737 -1.863635 0.370940
H 4.840055 -1.012299 0.186942
H 2.575718 3.065104 0.234959
H 0.825657 3.114931 -0.126773
H 1.414979 3.516705 1.513905
H -0.768650 1.745217 -1.129497
H -3.477230 -1.787489 1.146815
H 0.011444 -2.396250 1.513265
H -1.590065 -3.187398 1.405988
H -0.503625 -3.110453 -0.022840
H -3.217700 2.114199 -0.750014
H -4.577426 0.335074 0.407518


