%chk=000034863.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034863

0 1
 O   -1.178100      -1.798700      -1.363900    
 N    1.031900       2.033200     -0.3367000    
 N   -2.966900      0.2530000      0.6871000    
 C  -0.1929000      0.2029000     -0.6143000    
 C    1.102300     -0.1909000     -0.1761000    
 C    1.851000      0.9761000     -9.4999997E-03
 C   -2.751400     -0.1088000     -0.7091000    
 C   -1.317100     -0.6351000     -0.9212000    
 C  -0.2054000       1.575800     -0.7032000    
 C    1.711600      -1.432000      9.5799997E-02
 C    3.183900      0.9640000      0.4168000    
 C    3.044000      -1.459600      0.5229000    
 C    3.767100     -0.2788000      0.6804000    
 C   -2.771300     -0.9086000       1.556400    
 C   -4.308700      0.8074000      0.8747000    
 H   -3.454900     -0.8847000      -1.038400    
 H   -2.890500      0.7535000      -1.372200    
 H  -0.9755000       2.276200     -0.9959000    
 H    1.305400       3.005700     -0.3104000    
 H    1.164200      -2.363200     -1.8300001E-02
 H    3.747600       1.882800      0.5396000    
 H    3.518900      -2.413900      0.7347000    
 H    4.800800     -0.3234000       1.013500    
 H   -1.737600      -1.268300       1.537700    
 H   -3.434600      -1.740200       1.291300    
 H   -2.970800     -0.6386000       2.600200    
 H   -4.452600       1.124700       1.913500    
 H   -5.093900      8.5900001E-02  0.6213000    
 H   -4.445500       1.699300      0.2531000    


%chk=000034863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034863

0 1
O -0.982272 -2.187555 -0.839767
N 0.927505 1.835149 0.520816
N -3.165494 0.390457 0.493816
C -0.174114 -0.053150 -0.126932
C 1.260838 -0.340161 -0.110120
C 1.926878 0.864183 0.299096
C -2.705870 -0.502647 -0.598252
C -1.239371 -0.984092 -0.506115
C -0.322295 1.290546 0.268428
C 2.037036 -1.489586 -0.405561
C 3.328127 0.958896 0.425416
C 3.439519 -1.404557 -0.282185
C 4.078478 -0.198411 0.127914
C -3.165533 -0.296977 1.805395
C -4.484160 0.988431 0.186539
H -3.325272 -1.428528 -0.683717
H -2.807926 0.049142 -1.555178
H -1.256077 1.833586 0.403765
H 1.098070 2.790362 0.830142
H 1.539407 -2.410452 -0.719452
H 3.820504 1.886032 0.739365
H 4.054895 -2.283172 -0.505628
H 5.170480 -0.168563 0.213036
H -2.150627 -0.664091 2.035380
H -3.864736 -1.168771 1.838650
H -3.461015 0.415041 2.596502
H -4.769681 1.687773 0.992785
H -5.299921 0.229790 0.084812
H -4.426376 1.557023 -0.759150


