%chk=000079208.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079208

0 1
 O   -4.717600      0.7617000      0.2457000    
 N  -2.0600000E-02 -0.4324000      0.2062000    
 N    2.748000      0.2512000     -0.2691000    
 C   0.3547000      0.8531000     -0.3952000    
 C   0.9726000      -1.461800     -0.1243000    
 C    1.754200       1.280300      6.0500000E-02
 C    2.372600      -1.035200      0.3304000    
 C   -1.354900     -0.8395000     -0.2295000    
 C   -2.392800      0.1864000      0.2140000    
 C    4.081700      0.6585000      0.1686000    
 C   -3.797900     -0.2222000     -0.2072000    
 H  -0.3075000       1.662500     -7.6399997E-02
 H   0.3193000      0.8030000      -1.491900    
 H   0.9814000      -1.665600      -1.203700    
 H   0.7177000      -2.400200      0.3830000    
 H    2.011500       2.218200     -0.4467000    
 H    1.745600       1.484300       1.140100    
 H    2.403300     -0.9800000       1.427200    
 H    3.085800      -1.809600      2.2600001E-02
 H   -1.394900     -0.9694000      -1.319000    
 H   -1.608100      -1.806900      0.2223000    
 H   -2.362600      0.3237000       1.302600    
 H   -2.223600       1.174800     -0.2246000    
 H    4.826500     -9.1600001E-02 -0.1198000    
 H    4.137200      0.7998000       1.254000    
 H    4.375900       1.595800     -0.3166000    
 H   -4.073700      -1.184700      0.2355000    
 H   -3.874300     -0.2958000      -1.296700    
 H   -5.603200      0.4753000     -3.6200002E-02


%chk=000079208-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079208

0 1
O -4.838743 0.699181 0.332427
N -0.021678 -0.352424 0.102785
N 2.807854 0.238324 -0.205319
C 0.439742 0.929971 -0.487240
C 0.970197 -1.423004 -0.173793
C 1.822684 1.311556 0.065569
C 2.349597 -1.040507 0.386054
C -1.382550 -0.742497 -0.340474
C -2.481604 0.216296 0.162689
C 4.170458 0.602151 0.225007
C -3.884259 -0.329558 -0.117786
H -0.278451 1.728361 -0.230985
H 0.502683 0.862328 -1.603995
H 1.072243 -1.615045 -1.272647
H 0.624722 -2.357551 0.307686
H 2.168364 2.242065 -0.423264
H 1.726201 1.512113 1.163806
H 2.278902 -0.975638 1.502593
H 3.081619 -1.831132 0.134010
H -1.441839 -0.824075 -1.459440
H -1.577758 -1.756236 0.064514
H -2.357674 0.370059 1.250027
H -2.402076 1.205695 -0.324291
H 4.875912 -0.201732 -0.053173
H 4.257506 0.771594 1.329051
H 4.488247 1.527826 -0.288104
H -4.042718 -1.282633 0.433761
H -4.007552 -0.530754 -1.205477
H -5.763729 0.378966 0.181810


