%chk=000041983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041983

0 1
 O   0.6222000      -1.981200       1.361500    
 N   -1.444400      -2.318300      0.4084000    
 C   5.4499999E-02 -0.3580000     -0.3545000    
 C    1.513900      0.1237000     -6.0300000E-02
 C  -0.9798000      0.7619000     -7.9099998E-02
 C  -0.2324000      -1.623800      0.5371000    
 C    2.516100     -0.7790000     -0.2328000    
 C   -1.293100       1.609900      -1.104500    
 C    1.676200       1.410700      0.3474000    
 C   -1.520600      0.8394000       1.173900    
 C   7.3000002E-03 -0.7854000      -1.790600    
 C    3.817000     -0.3498000      2.9999999E-02
 C   -2.224100       2.618600     -0.8565000    
 C    2.977200       1.840000      0.6101000    
 C   -2.451700       1.848100       1.422000    
 C   -1.782200      -3.488100       1.218100    
 C   -2.482000      -1.938100     -0.5462000    
 C    4.047500      0.9598000      0.4513000    
 C   -2.803400       2.737600      0.4068000    
 C  -1.8100001E-02  -1.127900      -2.942400    
 H    2.358000      -1.796500     -0.5737000    
 H  -0.8426000       1.566900      -2.089200    
 H   0.8972000       2.145400      0.4926000    
 H   -1.247800      0.1789000       1.989000    
 H    4.650900      -1.034000     -9.6799999E-02
 H   -2.492900       3.316000      -1.644600    
 H    3.158000       2.859500      0.9384000    
 H   -2.898300       1.944900       2.407300    
 H  -0.9682000      -3.739700       1.902300    
 H   -2.681800      -3.268500       1.800100    
 H   -1.966600      -4.337700      0.5544000    
 H   -3.422000      -1.818400      3.4000000E-03
 H   -2.323300      -1.029500      -1.110900    
 H   -2.601600      -2.761200      -1.258500    
 H    5.060500       1.294300      0.6551000    
 H   -3.526000       3.524800      0.6008000    
 H  -4.1299999E-02  -1.431400      -3.962800    


%chk=000041983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041983

0 1
O 0.374753 -1.903396 1.579981
N -1.500586 -2.340786 0.290983
C 0.015013 -0.375432 -0.346381
C 1.464530 0.104171 -0.014310
C -1.021904 0.744079 -0.060862
C -0.353424 -1.616201 0.581553
C 2.530657 -0.829762 -0.061025
C -1.568644 1.540074 -1.095387
C 1.756645 1.461080 0.253860
C -1.383879 1.018014 1.283499
C 0.032421 -0.783495 -1.770405
C 3.858089 -0.416963 0.168151
C -2.472337 2.585446 -0.795325
C 3.089382 1.876775 0.484065
C -2.288718 2.058524 1.582391
C -1.811857 -3.513707 1.132862
C -2.479584 -2.068206 -0.775705
C 4.145038 0.941406 0.443737
C -2.838244 2.847351 0.544079
C 0.100764 -1.111925 -2.956404
H 2.320355 -1.883764 -0.268066
H -1.283394 1.342208 -2.134542
H 0.951984 2.201265 0.287081
H -0.946353 0.421326 2.092498
H 4.668361 -1.153925 0.136090
H -2.886025 3.194320 -1.607125
H 3.297054 2.932372 0.693076
H -2.560924 2.257367 2.624971
H -0.965076 -3.699359 1.809206
H -2.721782 -3.329593 1.736164
H -1.983157 -4.400196 0.493931
H -3.493227 -2.269263 -0.382097
H -2.446170 -1.019907 -1.099101
H -2.305579 -2.714496 -1.657144
H 5.177196 1.263101 0.623231
H -3.539532 3.656306 0.777150
H 0.180454 -1.400910 -3.988079


