%chk=000133460.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133460

0 1
 O   0.6293000       2.859900      0.2113000    
 O   -2.218700      -1.869800      0.1402000    
 N    4.125700     -0.9881000     -0.1326000    
 C    2.136000      0.4304000     -7.3200002E-02
 C   0.6369000      0.4551000      0.1048000    
 C    2.780700     -0.8747000      0.4365000    
 C  -9.1300003E-02 -0.7486000      7.6700002E-02
 C    1.943500      -2.088300      0.1241000    
 C  -4.3800000E-02   1.674400      0.2119000    
 C   -1.487800     -0.7162000      0.1639000    
 C   0.6157000      -2.026400     -4.9500000E-02
 C   -2.155200      0.5035000      0.2839000    
 C   -1.434900       1.696200      0.3085000    
 C   -3.644800      0.5534000      0.3847000    
 C   0.8497000       3.478200      -1.054300    
 C   -2.641000      -2.339000      -1.136900    
 H    2.336400      0.5596000      -1.146000    
 H    2.603300       1.274400      0.4497000    
 H    2.880500     -0.8195000       1.528500    
 H    2.430600      -3.059300      8.1600003E-02
 H   5.9000000E-02  -2.936100     -0.2417000    
 H   -1.951600       2.649300      0.3934000    
 H    4.625200      -1.751200      0.3232000    
 H    4.656800     -0.1428000      7.4400000E-02
 H   -4.027100     -0.2443000       1.030100    
 H   -3.983100       1.498600      0.8235000    
 H   -4.095600      0.4611000     -0.6081000    
 H  -0.1040000       3.758900      -1.512400    
 H    1.405200       2.815100      -1.724300    
 H    1.439400       4.385000     -0.8939000    
 H   -3.420900      -1.689900      -1.545200    
 H   -3.057300      -3.342400      -1.011100    
 H   -1.803600      -2.396300      -1.839500    


%chk=000133460-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133460

0 1
O 0.647069 2.921885 0.221865
O -2.178875 -1.972488 0.133290
N 4.224338 -0.937386 0.071572
C 2.178430 0.428983 -0.156539
C 0.668662 0.470129 0.022764
C 2.810154 -0.822915 0.493397
C -0.063022 -0.756153 0.010709
C 2.029078 -2.067687 0.094578
C -0.048253 1.679057 0.154492
C -1.481114 -0.729778 0.108032
C 0.680187 -2.024440 -0.098529
C -2.199163 0.486516 0.271311
C -1.454759 1.688501 0.296668
C -3.706148 0.492593 0.448435
C 0.921997 3.524919 -1.093748
C -2.797838 -2.343926 -1.152025
H 2.431270 0.385414 -1.237387
H 2.628189 1.351970 0.253434
H 2.701623 -0.718762 1.606012
H 2.572918 -3.019962 0.036854
H 0.105967 -2.936941 -0.287530
H -1.959052 2.649152 0.449378
H 4.675790 -1.808002 0.373491
H 4.789988 -0.117358 0.317098
H -4.044420 -0.438572 0.934033
H -4.024916 1.349916 1.065860
H -4.234859 0.573970 -0.521888
H -0.020473 3.726776 -1.640545
H 1.566625 2.868819 -1.711824
H 1.444226 4.472216 -0.887516
H -3.551889 -1.597636 -1.469088
H -3.287743 -3.314891 -0.979111
H -2.030788 -2.443720 -1.945344


