%chk=000097385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097385

0 1
 O    1.461000      -2.858800     -8.5000005E-03
 N  -0.1054000      0.8709000      9.6000005E-03
 N    5.483700      0.3326000     -6.8999999E-03
 C    1.289700      0.7487000      7.6000001E-03
 C    1.882000     -0.5258000     -9.9999997E-05
 C  -0.9304000     -0.2316000      9.4999997E-03
 C    1.003100      -1.723100     -3.0000000E-03
 C   -2.387000      1.3000000E-02  3.3000000E-03
 C  -0.4683000      -1.494800     -9.9999997E-05
 C    3.271700     -0.6699000     -4.6999999E-03
 C    2.113600       1.878700      8.8999998E-03
 C    4.079300      0.4668000     -2.3000001E-03
 C    3.502700       1.737100      4.4999998E-03
 C   -3.083300      0.1170000       1.208400    
 C   -3.069200      0.1411000      -1.207400    
 C   -4.458900      0.3487000       1.202600    
 C   -4.444700      0.3729000      -1.213200    
 C   -5.139500      0.4766000     -8.1000002E-03
 H  -0.5228000       1.792700      1.4300000E-02
 H   -1.115700      -2.364700     -5.7000001E-03
 H    3.727000      -1.656900     -1.0300000E-02
 H    1.680900       2.876100      1.3600000E-02
 H    4.126000       2.628000      6.0000001E-03
 H   -2.566900      2.0500001E-02   2.160400    
 H   -2.541600      6.3500002E-02  -2.155100    
 H   -5.000000      0.4297000       2.140800    
 H   -4.974700      0.4728000      -2.155800    
 H   -6.210400      0.6571000     -1.2600000E-02
 H    6.070900       1.156000     -4.4999998E-03
 H    5.904400     -0.5871000     -1.1200000E-02


%chk=000097385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097385

0 1
O 1.560711 -2.817237 0.934904
N -0.106178 0.819345 -0.195551
N 5.525493 0.345826 -0.092147
C 1.294872 0.711942 -0.174753
C 1.897196 -0.525260 0.205464
C -0.941452 -0.239958 0.139776
C 1.046812 -1.694748 0.583266
C -2.404929 0.015458 0.060649
C -0.390461 -1.463013 0.513378
C 3.305023 -0.638762 0.228302
C 2.118695 1.817958 -0.515209
C 4.134277 0.455520 -0.114599
C 3.513682 1.693277 -0.486596
C -3.292257 -0.601967 0.983362
C -2.947634 0.880497 -0.930305
C -4.679991 -0.360586 0.917819
C -4.336582 1.124877 -0.991573
C -5.209152 0.506954 -0.066800
H -0.522474 1.732002 -0.387088
H -1.047288 -2.308663 0.731109
H 3.719125 -1.609292 0.526162
H 1.665209 2.774388 -0.804355
H 4.140021 2.553411 -0.752848
H -2.886219 -1.251961 1.765627
H -2.293833 1.324269 -1.691668
H -5.348148 -0.841464 1.640556
H -4.738264 1.784514 -1.768648
H -6.287096 0.695671 -0.114572
H 6.118356 1.133235 -0.335807
H 5.969689 -0.528431 0.172146


