%chk=000070349.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070349

0 1
 O    1.279800       2.400500      0.1204000    
 N    1.079200      0.1695000     -0.6356000    
 N    1.754000      -1.015600     -0.4933000    
 C  -0.1154000      0.2982000      -1.432300    
 C    2.849700      0.6552000      0.7325000    
 C    1.646000       1.239500      5.5399999E-02
 C    2.765000     -0.7696000      0.2798000    
 C   -1.357100      4.0100001E-02 -0.6287000    
 C    3.767500      -1.788000      0.6950000    
 C   -1.864600      -1.251100     -0.5428000    
 C   -1.987400       1.094900      2.0900000E-02
 C   -3.018600      -1.490900      0.2034000    
 C   -3.141300      0.8552000      0.7672000    
 C   -3.656800     -0.4377000      0.8583000    
 H  -4.7899999E-02 -0.3949000      -2.279700    
 H  -0.1526000       1.308600      -1.857900    
 H    2.757700      0.7210000       1.818100    
 H    3.767300       1.121500      0.3695000    
 H    3.525100      -2.761500      0.2610000    
 H    3.770500      -1.869900       1.784900    
 H    4.759600      -1.478900      0.3557000    
 H   -1.374600      -2.079000      -1.047800    
 H   -1.597400       2.106700     -4.3600000E-02
 H   -3.419800      -2.497700      0.2747000    
 H   -3.638500       1.675200       1.276900    
 H   -4.555200     -0.6243000       1.439400    


%chk=000070349-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070349

0 1
O 1.376708 2.570470 -0.126814
N 1.117969 0.281300 -0.692321
N 1.738984 -0.978561 -0.429352
C -0.123475 0.336444 -1.478097
C 2.947986 0.736313 0.663623
C 1.748215 1.366315 -0.069281
C 2.791124 -0.739000 0.341381
C -1.373215 0.032190 -0.656711
C 3.690594 -1.842954 0.808510
C -1.932929 -1.268894 -0.646346
C -1.981594 1.053800 0.117054
C -3.084764 -1.547738 0.124305
C -3.131598 0.776451 0.889091
C -3.687145 -0.525069 0.893187
H -0.017072 -0.378536 -2.311743
H -0.173123 1.360482 -1.889301
H 2.898622 0.950881 1.746505
H 3.898612 1.161036 0.292579
H 3.333435 -2.812043 0.423884
H 3.721966 -1.891668 1.913848
H 4.730552 -1.686553 0.463055
H -1.461124 -2.063958 -1.236215
H -1.545675 2.060292 0.114703
H -3.511241 -2.557262 0.124987
H -3.595902 1.572653 1.481876
H -4.581709 -0.739388 1.488994


