%chk=000098172.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098172

0 1
 O    3.139800      -1.690500      -1.051100    
 O    1.881100      -1.796800      0.8189000    
 N   0.4907000      0.5161000     -5.4000001E-02
 C    2.786600       1.337900      0.2027000    
 C    1.863400      0.2806000     -0.4399000    
 C    4.214000       1.271600     -0.3473000    
 C    2.805100       1.272600       1.733100    
 C  -0.4240000     -0.3617000     -0.7795000    
 C    2.267000      -1.163700     -0.1573000    
 C   -1.855600     -0.1443000     -0.3670000    
 C   -2.384200     -0.8834000      0.6821000    
 C   -2.626400      0.7926000      -1.041100    
 C   -3.710400     -0.6819000       1.064700    
 C   -3.952600      0.9941000     -0.6586000    
 C   -4.494600      0.2567000      0.3944000    
 H    2.399000       2.329800     -7.1400002E-02
 H    1.929400      0.4140000      -1.529600    
 H   0.2421000       1.488200     -0.2379000    
 H    4.810000       2.110700      2.7799999E-02
 H    4.214600       1.326600      -1.440900    
 H    4.719400      0.3474000     -4.9300000E-02
 H    3.222700      0.3258000       2.090400    
 H    3.421400       2.080600       2.142800    
 H    1.800800       1.384100       2.153500    
 H  -0.1959000      -1.423000     -0.6273000    
 H  -0.3372000     -0.1899000      -1.861000    
 H   -1.781500      -1.615400       1.212400    
 H   -2.213700       1.373500      -1.861200    
 H   -4.132200      -1.255500       1.884800    
 H   -4.563200       1.725300      -1.180000    
 H    3.391500      -2.609700     -0.8191000    
 H   -5.527100      0.4139000      0.6924000    


%chk=000098172-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000098172

0 1
O 3.408061 -1.551332 -1.072915
O 1.749660 -2.004356 0.481658
N 0.507922 0.495729 -0.213764
C 2.808192 1.238028 0.355065
C 1.924069 0.281374 -0.529121
C 4.256927 1.354497 -0.166412
C 2.761767 0.859553 1.853279
C -0.488856 -0.183799 -1.067575
C 2.296655 -1.187076 -0.286180
C -1.898794 0.002736 -0.521071
C -2.166666 -0.253956 0.848721
C -2.961340 0.407097 -1.365274
C -3.474792 -0.112590 1.360118
C -4.273789 0.546826 -0.855252
C -4.534003 0.286999 0.509389
H 2.330822 2.236208 0.237573
H 2.179834 0.491174 -1.597019
H 0.287584 1.486043 -0.057932
H 4.817237 2.092040 0.436986
H 4.283951 1.682312 -1.222163
H 4.784927 0.387201 -0.104183
H 3.334445 -0.066040 2.048917
H 3.205049 1.665215 2.466480
H 1.723147 0.689050 2.184507
H -0.241296 -1.263766 -1.067397
H -0.453539 0.154247 -2.132508
H -1.336404 -0.559456 1.494752
H -2.762867 0.613313 -2.424783
H -3.671791 -0.317355 2.418813
H -5.087691 0.860108 -1.519166
H 3.641210 -2.499307 -0.873852
H -5.549631 0.395582 0.906809


