%chk=000043141.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043141

0 1
 O   0.8211000      1.8400000E-02   1.912400    
 N   -3.154800      0.1619000      0.1578000    
 N    4.905500      0.6150000     -0.8451000    
 C   -3.705100       1.446500     -0.2739000    
 C   -3.947900     -0.8463000     -0.5449000    
 C   -5.206300       1.199700     -0.2514000    
 C   -5.365800     -0.3075000     -0.4259000    
 C   -1.731700      4.4399999E-02 -0.1232000    
 C   -1.206200      -1.306900      0.3657000    
 C   0.2911000      -1.479900      9.6100003E-02
 C    1.159200     -0.4737000      0.8385000    
 C    2.473600     -9.1899998E-02  0.2480000    
 C    3.145900      -1.010400     -0.5185000    
 C    2.966900       1.165700      0.4903000    
 C    4.362600     -0.6069000      -1.044700    
 C    4.191600       1.471800     -8.0899999E-02
 H   -3.387700       1.703400      -1.292900    
 H   -3.421100       2.264000      0.3962000    
 H   -3.886200      -1.838400     -8.7700002E-02
 H   -3.668300     -0.9243000      -1.603400    
 H   -5.716300       1.755800      -1.044500    
 H   -5.637900       1.509600      0.7076000    
 H   -5.872000     -0.7299000      0.4501000    
 H   -5.963800     -0.5521000      -1.309700    
 H   -1.524900      0.1565000      -1.195600    
 H   -1.203000      0.8541000      0.3922000    
 H   -1.402300      -1.416200       1.439900    
 H   -1.714300      -2.134500     -0.1414000    
 H   0.4609000      -1.389600     -0.9828000    
 H   0.6008000      -2.482600      0.4121000    
 H    2.784100      -2.013000     -0.7106000    
 H    2.442600       1.900800       1.089400    
 H    4.953500      -1.279800      -1.657500    
 H    4.644400       2.447000      6.5099999E-02


%chk=000043141-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043141

0 1
O 0.741458 0.851111 1.359025
N -3.340837 0.132077 0.039271
N 5.432686 0.194002 -0.511939
C -4.043315 1.379654 -0.356280
C -4.158282 -0.976099 -0.524530
C -5.523667 1.043355 -0.078256
C -5.632778 -0.481219 -0.413690
C -1.908248 0.101318 -0.303738
C -1.159858 -1.051468 0.400188
C 0.325281 -1.137228 -0.003287
C 1.200743 -0.017659 0.564376
C 2.660371 0.026016 0.168663
C 3.260909 -0.924385 -0.697328
C 3.481510 1.061693 0.685625
C 4.635118 -0.800335 -1.003728
C 4.843429 1.106212 0.322536
H -3.896803 1.617075 -1.443064
H -3.671273 2.236891 0.232519
H -3.985751 -1.915642 0.029733
H -3.893628 -1.163805 -1.598500
H -6.212564 1.662367 -0.679172
H -5.748056 1.215312 0.988410
H -6.181920 -1.019170 0.377551
H -6.170409 -0.650291 -1.363364
H -1.757310 0.011184 -1.415903
H -1.459042 1.058652 0.015572
H -1.248329 -0.904227 1.491506
H -1.645322 -2.014979 0.153675
H 0.425678 -1.140784 -1.109074
H 0.759599 -2.100850 0.336845
H 2.686426 -1.748745 -1.130162
H 3.042787 1.806073 1.357092
H 5.127497 -1.519113 -1.668335
H 5.502100 1.893703 0.704562


