%chk=000072896.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072896

0 1
 O  -0.6933000       1.952100      0.2234000    
 N   0.1830000     -0.2076000     -4.7300000E-02
 N    4.708400      -1.929600     -0.2525000    
 C    1.581700      1.4300000E-02 -1.6600000E-02
 C   -2.203200      0.1935000      2.6799999E-02
 C    2.440800      -1.062900     -0.1494000    
 C  -0.8524000      0.7304000      6.9100000E-02
 C    2.057600       1.303900      0.1468000    
 C    3.817900     -0.8440000     -0.1177000    
 C    3.434900       1.523000      0.1785000    
 C    4.315000      0.4490000      4.6200000E-02
 C   -3.256500      0.9894000     -0.4238000    
 C   -2.445700      -1.117300      0.4372000    
 C   -4.552200      0.4744000     -0.4640000    
 C   -3.741400      -1.632300      0.3969000    
 C   -4.794600     -0.8364000     -5.3700000E-02
 H  -6.6600002E-02  -1.178800     -0.2128000    
 H    2.051800      -2.070300     -0.2768000    
 H    1.443800       2.185200      0.2556000    
 H    5.386100      0.6327000      7.2300002E-02
 H    3.823200       2.529400      0.3061000    
 H   -3.088600       2.011700     -0.7529000    
 H   -1.666300      -1.762100      0.8320000    
 H   -5.372300       1.093700     -0.8155000    
 H   -3.932400      -2.650000      0.7247000    
 H   -5.803700      -1.236800     -8.3200000E-02
 H    5.706900      -1.771200     -0.2280000    
 H    4.349000      -2.867600     -0.3697000    


%chk=000072896-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072896

0 1
O -0.708262 2.030291 0.083029
N 0.200057 -0.134386 -0.065623
N 4.703048 -1.969147 -0.257003
C 1.602295 0.119179 -0.016772
C -2.232985 0.143713 0.002811
C 2.454096 -1.007102 -0.158957
C -0.858704 0.770746 0.017746
C 2.147568 1.416999 0.169215
C 3.865154 -0.859282 -0.116428
C 3.553046 1.548087 0.212560
C 4.413899 0.442918 0.074388
C -3.312578 0.956030 -0.429671
C -2.496416 -1.183499 0.435497
C -4.625962 0.444341 -0.458287
C -3.813437 -1.693643 0.412070
C -4.880238 -0.884331 -0.042041
H -0.058091 -1.110814 -0.222834
H 2.020165 -2.006746 -0.303010
H 1.484692 2.276416 0.266911
H 5.501655 0.576579 0.110619
H 3.985632 2.544814 0.356628
H -3.094346 1.986357 -0.728675
H -1.694048 -1.814434 0.838642
H -5.451048 1.078477 -0.800449
H -4.008731 -2.714204 0.759289
H -5.901238 -1.281373 -0.059927
H 5.711973 -1.860343 -0.227652
H 4.323706 -2.899845 -0.400375


