%chk=000159903.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159903

1 1
 O    2.302700      -1.360100     -0.4715000    
 N    3.289400      0.5886000      0.1150000    
 N   -1.398800      0.8087000     -0.2577000    
 C    4.263600     -0.3915000      0.1116000    
 C    2.232800     -5.2000001E-02 -0.2225000    
 C    3.648400      -1.579400     -0.2486000    
 C    3.470300       1.976700      0.4295000    
 C    5.646000     -5.8800001E-02  0.4531000    
 C   0.9472000      0.6585000     -0.3343000    
 C  -0.2573000      0.1082000     -0.1332000    
 C   -2.718800      0.3435000     -8.1400000E-02
 C   -3.794200       1.215000     -0.2536000    
 C   -2.948700     -0.9880000      0.2654000    
 C   -5.099400      0.7550000     -7.9000004E-02
 C   -4.253900      -1.447900      0.4397000    
 C   -5.329300     -0.5765000      0.2674000    
 H    3.982900      -2.597200     -0.3863000    
 H    3.449500       2.562600     -0.4944000    
 H    2.674100       2.320300       1.097500    
 H    4.419000       2.161400      0.9383000    
 H    6.297700     -0.9302000      0.3285000    
 H    6.034400      0.7343000     -0.1935000    
 H    5.726900      0.2639000       1.495700    
 H    1.001600       1.716100     -0.5834000    
 H  -0.3238000     -0.9389000      0.1294000    
 H   -1.311100       1.787900     -0.5094000    
 H   -3.629300       2.254900     -0.5238000    
 H   -2.156000      -1.712400      0.4135000    
 H   -5.936900       1.433400     -0.2130000    
 H   -4.434000      -2.484500      0.7097000    
 H   -6.345600     -0.9346000      0.4032000    


%chk=000159903-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159903

1 1
O 2.173921 -1.171555 0.195423
N 3.413726 0.688814 0.150007
N -1.525746 0.896948 -0.007271
C 4.325901 -0.413934 0.225912
C 2.123725 0.213479 0.132708
C 3.550432 -1.543288 0.252818
C 3.773523 2.116015 0.097526
C 5.811709 -0.253101 0.261686
C 0.909304 0.928816 0.065038
C -0.325711 0.270892 0.058944
C -2.829319 0.300018 -0.012930
C -3.940635 1.175324 -0.107879
C -3.027375 -1.100840 0.073249
C -5.248696 0.650219 -0.117492
C -4.340918 -1.612559 0.061992
C -5.455265 -0.745589 -0.033006
H 3.761122 -2.604947 0.306163
H 3.408094 2.572224 -0.838435
H 3.348084 2.653130 0.962466
H 4.867112 2.215466 0.129584
H 6.293221 -1.241154 0.325558
H 6.192148 0.244456 -0.648938
H 6.140264 0.334042 1.138512
H 0.967350 2.020265 0.017707
H -0.346440 -0.820955 0.109229
H -1.525745 1.921826 -0.060259
H -3.787965 2.260147 -0.174421
H -2.188529 -1.799404 0.150662
H -6.102996 1.330066 -0.190895
H -4.494555 -2.694224 0.128771
H -6.470337 -1.153598 -0.040528


