%chk=000054031.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054031

0 1
 O  -0.7588000     -4.1099999E-02 -0.6902000    
 O   -1.284500       1.153000       1.199300    
 N    1.414400     -0.8239000     -0.2427000    
 N    2.669900     -0.4035000     -1.2100000E-02
 N   -2.966900      0.2213000     -0.1007000    
 C    1.133000      -2.240600     -0.2500000    
 C   0.5305000      0.1894000     -0.4458000    
 C    2.560700      0.9262000     -7.4900001E-02
 C    1.245800       1.351500     -0.3433000    
 C   0.7559000      -2.759000       1.127200    
 C    3.751200       1.768400      0.1313000    
 C   -1.630300      0.5002000      0.2142000    
 C   -4.038900      0.7095000      0.7552000    
 C   -3.382100     -0.5513000      -1.267700    
 H   0.3232000      -2.424400     -0.9642000    
 H    2.023300      -2.758600     -0.6240000    
 H   0.8742000       2.360500     -0.4498000    
 H    1.563200      -2.589200       1.847500    
 H   0.5542000      -3.833700       1.086500    
 H  -0.1406000      -2.257200       1.506400    
 H    3.505900       2.832300      4.9500000E-02
 H    4.178100       1.598300       1.125100    
 H    4.518800       1.543100     -0.6163000    
 H   -4.608600     -0.1464000       1.128500    
 H   -4.694000       1.356400      0.1645000    
 H   -3.652100       1.276800       1.605400    
 H   -4.029600      7.5199999E-02  -1.888200    
 H   -3.942000      -1.426500     -0.9249000    
 H   -2.536700     -0.8887000      -1.870300    


%chk=000054031-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054031

0 1
O -0.843994 -0.121426 -0.129568
O -1.584465 2.069988 0.383798
N 1.408762 -0.786259 -0.381291
N 2.730010 -0.337597 -0.257717
N -3.099835 0.315991 -0.006441
C 1.135855 -2.186866 -0.723559
C 0.512951 0.217140 -0.060634
C 2.613452 0.971951 0.132511
C 1.242395 1.368192 0.269553
C 1.014257 -3.091847 0.520079
C 3.848841 1.800836 0.353269
C -1.846424 0.875084 0.109020
C -4.271240 1.184341 0.198241
C -3.370223 -1.093215 -0.331059
H 0.207854 -2.220506 -1.321441
H 1.971671 -2.517679 -1.362102
H 0.839869 2.334419 0.551128
H 1.942210 -3.049938 1.115588
H 0.842255 -4.139727 0.212996
H 0.172779 -2.774879 1.161364
H 3.881412 2.668037 -0.331901
H 3.891630 2.193590 1.385865
H 4.746972 1.185583 0.177298
H -4.880731 0.816826 1.045796
H -4.902293 1.200228 -0.710810
H -3.927335 2.205717 0.417218
H -3.927544 -1.167442 -1.285164
H -3.983433 -1.554954 0.466670
H -2.428458 -1.647589 -0.423209


