%chk=000085598.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085598

0 1
 O    3.140300      0.2973000      6.0800001E-02
 O  -0.6827000      -2.265500     -8.2000002E-02
 O   -2.884300       1.086300     -2.0199999E-02
 N  -0.9089000      4.6599999E-02  2.9300001E-02
 N    1.205800     -0.9661000      9.6900001E-02
 N   -2.372800     -3.7500001E-02 -4.6300001E-02
 C  -0.2928000       1.327700      0.3203000    
 C    1.063200       1.427500     -0.3503000    
 C    1.915600      0.2259000     -1.9400001E-02
 C  -0.1834000      -1.142100      1.0800000E-02
 H  -0.1835000       1.394400       1.409500    
 H  -0.9055000       2.167600     -2.1299999E-02
 H    1.579800       2.335100     -2.1500001E-02
 H   0.9541000       1.465800      -1.440300    
 H    1.759900      -1.810700      0.2087000    


%chk=000085598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085598

0 1
O 3.193617 0.217223 -0.088687
O -0.704103 -2.305461 0.046399
O -2.945568 1.050969 -0.151213
N -0.929575 0.062271 0.067967
N 1.206481 -0.968030 0.114691
N -2.330895 -0.057024 -0.215689
C -0.283250 1.359091 0.381037
C 1.074756 1.458298 -0.333669
C 1.938903 0.226102 -0.088099
C -0.196520 -1.166190 0.066575
H -0.161567 1.446350 1.477326
H -0.980336 2.150492 0.056500
H 1.635001 2.341509 0.012779
H 0.932360 1.566353 -1.426128
H 1.755495 -1.829654 0.215211