%chk=000027951.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027951

0 1
 O    2.754900      -1.477900      0.4107000    
 O    3.572800      0.6264000     -0.4321000    
 N   -4.153100     -0.4126000     -8.7600000E-02
 N   -4.565800      0.8793000      0.3491000    
 C   -1.888500      0.1744000      0.7046000    
 C   -2.744000     -0.3272000     -0.4824000    
 C  -0.4380000      0.3299000      0.3906000    
 C   0.4332000     -0.7443000      0.5872000    
 C   -2.299000      -1.703500     -0.9773000    
 C    1.765300     -0.5525000      0.2828000    
 C   3.9400000E-02   1.557700     -0.1010000    
 C    2.232400      0.6492000     -0.1983000    
 C    1.393300       1.725400     -0.4015000    
 C    3.897200     -0.7242000     -4.4700000E-02
 H   -1.999500     -0.5120000       1.556400    
 H   -2.244400       1.143700       1.077100    
 H   -2.643000      0.3730000      -1.323700    
 H   8.4200002E-02  -1.697500      0.9696000    
 H   -2.976800      -2.077700      -1.753800    
 H   -2.283900      -2.439200     -0.1654000    
 H   -1.303000      -1.665100      -1.428900    
 H  -0.6429000       2.390200     -0.2552000    
 H   -4.721000     -0.6974000     -0.8849000    
 H    1.765200       2.670200     -0.7812000    
 H    4.337500      -1.240200     -0.9057000    
 H    4.638800     -0.6896000      0.7617000    
 H   -4.592800       1.516000     -0.4470000    
 H   -5.524000      0.8206000      0.6912000    


%chk=000027951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027951

0 1
O 2.985479 -1.401412 0.517254
O 3.668838 0.679700 -0.477172
N -4.202218 -0.244338 -0.112740
N -4.659147 1.072207 0.178004
C -1.893086 -0.003372 0.757457
C -2.764364 -0.317838 -0.491776
C -0.425463 0.220503 0.431588
C 0.538591 -0.800839 0.689259
C -2.491141 -1.718998 -1.069110
C 1.867580 -0.541641 0.347040
C -0.004974 1.444636 -0.154126
C 2.268451 0.677287 -0.235273
C 1.351197 1.696979 -0.499106
C 4.155630 -0.640891 0.002626
H -2.018976 -0.833367 1.477829
H -2.332500 0.903432 1.214014
H -2.520575 0.445326 -1.271811
H 0.246285 -1.751203 1.145419
H -3.076009 -1.898537 -1.992421
H -2.762311 -2.495896 -0.330209
H -1.422900 -1.831400 -1.319924
H -0.750802 2.227429 -0.333565
H -4.795799 -0.755547 -0.787509
H 1.666169 2.644713 -0.943440
H 4.596563 -1.192095 -0.846434
H 4.871735 -0.482125 0.828083
H -4.936882 1.670041 -0.611135
H -5.264870 1.122349 0.997482


