%chk=000022446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022446

0 1
 O    2.618700       1.316700      0.8227000    
 O    3.275400      0.1109000     -0.8995000    
 N    2.484600      0.3997000      5.1000002E-03
 C   -2.166600      0.3583000     -0.1008000    
 C   -1.095900     -0.5806000     -0.6602000    
 C   -3.549000     -0.2941000     -0.1335000    
 C   0.2666000      5.2099999E-02 -0.5975000    
 C   -4.611000      0.6219000      0.4536000    
 C    1.305700     -0.3998000      0.1155000    
 C    1.471600      -1.585100      0.9947000    
 H   -2.186400       1.290000     -0.6802000    
 H   -1.916000      0.6291000      0.9328000    
 H   -1.319800     -0.8102000      -1.709000    
 H   -1.125200      -1.532700     -0.1216000    
 H   -3.818100     -0.5439000      -1.166300    
 H   -3.532500      -1.232000      0.4339000    
 H   0.3739000      0.9572000      -1.195200    
 H   -5.591300      0.1365000      0.4190000    
 H   -4.387800      0.8628000       1.497900    
 H   -4.675600       1.558600     -0.1092000    
 H    2.252500      -2.249500      0.6088000    
 H    1.750500      -1.280400       2.009400    
 H   0.5554000      -2.175500       1.077100    


%chk=000022446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022446

0 1
O 2.558497 1.586889 -0.604814
O 3.672415 -0.021572 0.564168
N 2.604220 0.447810 0.004320
C -2.218215 0.357242 0.007140
C -1.102472 -0.561235 -0.570221
C -3.624487 -0.267625 -0.137753
C 0.253515 0.088175 -0.514757
C -4.736257 0.632190 0.442768
C 1.373851 -0.402412 0.086216
C 1.568908 -1.696441 0.829665
H -2.194187 1.337164 -0.511081
H -2.008842 0.560899 1.075956
H -1.348400 -0.768515 -1.633873
H -1.115165 -1.534267 -0.046572
H -3.826990 -0.464740 -1.210322
H -3.641245 -1.253497 0.369653
H 0.350602 1.068098 -1.004034
H -5.732222 0.168150 0.323953
H -4.576034 0.816449 1.521617
H -4.758425 1.614359 -0.065615
H 2.322862 -2.330776 0.331335
H 1.937451 -1.513512 1.853804
H 0.620322 -2.252832 0.885949


