%chk=000087767.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087767

0 1
 O   -5.740100      7.2999999E-02  -1.119100    
 N   -4.554000      -2.188000      6.3199997E-02
 C    3.043300     -6.2500000E-02 -0.1808000    
 C    1.898700      0.2772000      0.7787000    
 C    4.429800      6.7100003E-02  0.4534000    
 C   0.4909000      0.2469000      0.1756000    
 C    5.534600     -0.1956000     -0.5724000    
 C  -0.6134000      0.5382000       1.194700    
 C    6.920400     -9.9200003E-02  6.5600000E-02
 C   -1.983800      0.4083000      0.5789000    
 C    8.019600     -0.3936000     -0.9426000    
 C   -2.629200     -0.8188000      0.6061000    
 C   -2.575200       1.518000     -5.2999998E-03
 C   -3.896300     -0.9387000      3.5300002E-02
 C   -3.842400       1.398000     -0.5758000    
 C   -4.502900      0.1695000     -0.5555000    
 H    2.906200      -1.084100     -0.5557000    
 H    2.981200      0.6040000      -1.050100    
 H    2.073900       1.276800       1.196600    
 H    1.936300     -0.4215000       1.624300    
 H    4.550800       1.074100      0.8707000    
 H    4.517100     -0.6411000       1.286000    
 H   0.4374000      0.9726000     -0.6459000    
 H   0.3252000     -0.7406000     -0.2742000    
 H    5.456000      0.5276000      -1.393100    
 H    5.400100      -1.193700      -1.007200    
 H  -0.5291000     -0.1475000       2.047600    
 H  -0.4855000       1.546300       1.609200    
 H    7.070000      0.9045000      0.4803000    
 H    6.998000     -0.8089000      0.8975000    
 H    7.989900      0.3179000      -1.774200    
 H    9.001700     -0.3177000     -0.4656000    
 H    7.917400      -1.404100      -1.350800    
 H   -2.152600      -1.681200       1.065700    
 H   -2.067700       2.478200     -2.7899999E-02
 H   -4.302500       2.269800      -1.033400    
 H   -5.472400      -2.281800     -0.3498000    
 H   -4.107500      -2.987400      0.4924000    
 H   -5.994900      0.9407000      -1.477000    


%chk=000087767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087767

0 1
O -5.855350 -0.061082 -1.114989
N -4.603601 -2.200678 -0.069072
C 3.051637 0.007408 -0.186295
C 1.924661 0.347683 0.814899
C 4.466325 0.120980 0.425761
C 0.509932 0.231815 0.205820
C 5.596455 -0.229584 -0.568232
C -0.615030 0.568599 1.223911
C 7.009424 -0.118125 0.049076
C -2.011787 0.444724 0.630783
C 8.133845 -0.478096 -0.945979
C -2.656854 -0.817037 0.581306
C -2.670556 1.572326 0.082888
C -3.938435 -0.978934 -0.004728
C -3.951456 1.434462 -0.507106
C -4.574092 0.176756 -0.550664
H 2.900624 -1.022828 -0.571541
H 2.976789 0.680767 -1.065698
H 2.074958 1.378348 1.200335
H 2.001306 -0.325564 1.695024
H 4.619165 1.153304 0.805156
H 4.536896 -0.547350 1.309786
H 0.420873 0.908875 -0.667640
H 0.352277 -0.795459 -0.180987
H 5.529890 0.438880 -1.452288
H 5.444623 -1.261787 -0.948314
H -0.508783 -0.106158 2.097311
H -0.454812 1.599250 1.597899
H 7.161878 0.914559 0.424542
H 7.071573 -0.782433 0.935450
H 8.112997 0.191249 -1.826924
H 9.132668 -0.391630 -0.479587
H 8.020541 -1.516010 -1.312566
H -2.156710 -1.695717 1.010328
H -2.190662 2.556680 0.117616
H -4.461505 2.312126 -0.927010
H -5.523448 -2.237835 -0.499303
H -4.187508 -3.044997 0.308989
H -6.239749 0.775212 -1.472557


