%chk=000063123.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063123

0 1
 O    1.824400      -2.883800     -0.1092000    
 N   0.5842000      0.8562000      0.7428000    
 N   0.2008000      -1.514000      0.7277000    
 C  -0.1650000     -0.2925000      0.9879000    
 C    1.861100      0.7004000      0.1604000    
 C   -1.540000     -0.1652000       1.615400    
 C    2.311600     -0.5969000     -0.1441000    
 C   -2.582000     -2.1500001E-02  0.5548000    
 C   0.1393000       2.213200       1.049300    
 C    2.724300       1.769500     -0.1387000    
 C    1.429900      -1.753100      0.1576000    
 C    3.569300     -0.8192000     -0.7224000    
 C    3.979900       1.551400     -0.7151000    
 C   -3.194800      -1.155300      2.4400000E-02
 C   -2.938700       1.245900      9.8200001E-02
 C    4.401500      0.2590000      -1.006300    
 C   -4.167800      -1.021100     -0.9660000    
 C   -3.911700       1.380200     -0.8923000    
 C   -4.526300      0.2467000      -1.424300    
 H   -1.596900      0.6328000       2.358300    
 H   -1.738100      -1.078400       2.194400    
 H  -0.1034000       2.754100      0.1283000    
 H   0.9149000       2.767000       1.591900    
 H  -0.7220000       2.267600       1.712900    
 H    2.444000       2.801200      5.4400001E-02
 H    3.915500      -1.821900     -0.9571000    
 H    4.625800       2.395800     -0.9383000    
 H   -2.924400      -2.149000      0.3713000    
 H   -2.505000       2.148100      0.5113000    
 H    5.376200      9.1799997E-02  -1.454600    
 H   -4.646400      -1.903600      -1.380400    
 H   -4.196300       2.367400      -1.244300    
 H   -5.285000      0.3512000      -2.194300    


%chk=000063123-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063123

0 1
O 1.955573 -3.095188 0.420761
N 0.610528 0.799667 0.549786
N 0.308460 -1.549136 1.037630
C -0.118261 -0.290200 1.050296
C 1.930303 0.582261 0.073653
C -1.500906 -0.052922 1.647539
C 2.434588 -0.754047 0.045085
C -2.609059 0.139036 0.605443
C 0.062384 2.171952 0.505502
C 2.756596 1.653421 -0.366704
C 1.579977 -1.888658 0.497532
C 3.748105 -0.997015 -0.427510
C 4.058005 1.386896 -0.829447
C -2.725671 -0.757777 -0.487680
C -3.555004 1.186266 0.737893
C 4.562130 0.061060 -0.864983
C -3.765429 -0.603798 -1.430463
C -4.598620 1.339278 -0.204151
C -4.704798 0.445615 -1.293830
H -1.492103 0.795991 2.356130
H -1.704951 -0.966103 2.232339
H 0.185578 2.591659 -0.508037
H 0.577078 2.827405 1.232160
H -1.011133 2.158535 0.724333
H 2.400816 2.686371 -0.342991
H 4.089968 -2.037315 -0.437144
H 4.687155 2.219227 -1.163739
H -2.007752 -1.580422 -0.586166
H -3.486265 1.876218 1.589529
H 5.576273 -0.131692 -1.229173
H -3.846631 -1.305064 -2.268547
H -5.325825 2.150546 -0.085898
H -5.512211 0.561932 -2.025249


