%chk=000083359.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083359

0 1
 O   -1.774000      0.2305000      0.3948000    
 O  -0.5308000     -0.7330000      -1.291700    
 O    2.836200       1.455900     -0.5324000    
 N    1.781000     -0.2681000      7.1699999E-02
 N    2.817000      0.5253000      0.2821000    
 C   0.5422000      0.1748000      0.6966000    
 C  -0.6147000     -0.1769000     -0.2050000    
 C   -2.974000     -3.1800002E-02 -0.3398000    
 C    2.076200      -1.652500      0.4698000    
 C   -4.159000      0.4758000      0.4538000    
 H   0.3898000     -0.2620000       1.691300    
 H   0.5152000       1.268800      0.8007000    
 H   -2.929300      0.4809000      -1.307100    
 H   -3.073100      -1.110700     -0.5039000    
 H    2.949600      -2.034700     -7.3600002E-02
 H    1.243400      -2.320000      0.2202000    
 H    2.277300      -1.743300       1.544800    
 H   -5.095300      0.2911000     -7.9999998E-02
 H   -4.206500     -1.4800000E-02   1.431600    
 H   -4.065100       1.550500      0.6417000    


%chk=000083359-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083359

0 1
O -1.779287 0.232190 0.434794
O -0.505222 -0.824053 -1.212912
O 2.723953 1.694094 -0.161104
N 1.855810 -0.323775 0.363208
N 2.936212 0.428226 -0.095628
C 0.580226 0.298487 0.723041
C -0.584102 -0.177155 -0.145665
C -3.032199 -0.105315 -0.319448
C 2.066737 -1.773663 0.419702
C -4.192224 0.496638 0.464830
H 0.331380 0.128011 1.786472
H 0.722651 1.391043 0.581121
H -2.942126 0.312325 -1.338139
H -3.096162 -1.205386 -0.400306
H 3.109039 -1.965605 0.120038
H 1.382852 -2.288735 -0.277120
H 1.904114 -2.153728 1.445434
H -5.144303 0.273957 -0.050295
H -4.242492 0.076183 1.483597
H -4.088758 1.592062 0.543982


