%chk=000065764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065764

0 1
 O    4.434600      0.3133000     -0.4611000    
 O    2.719000       3.050800      0.5086000    
 O  -0.4825000      -4.913800      0.1069000    
 O   -2.184700      -3.704400      0.7843000    
 N    2.184500      0.8780000     -0.1416000    
 N  -0.2371000       2.080300       1.241400    
 N  -0.9999000      -3.804400      0.3829000    
 C    1.337600     -0.2784000     -2.9500000E-02
 C  -1.4200000E-02 -0.2081000      0.3671000    
 C  -0.7244000       1.089000      0.5747000    
 C    2.059600       2.019000      0.6595000    
 C  -0.7746000      -1.381800      0.5202000    
 C    1.086200       1.925100       1.807400    
 C    1.860100      -1.549900     -0.3393000    
 C    3.282900      0.8349000      -1.106800    
 C   -2.074100       1.277200     -3.1599998E-02
 C  -0.2209000      -2.626400      0.2372000    
 C    1.092200      -2.709200     -0.2045000    
 C   -2.394200      0.6188000      -1.212700    
 C   -2.997100       2.108500      0.5914000    
 C   -3.656600      0.7945000      -1.779600    
 C   -4.259400       2.284000      2.4499999E-02
 C   -4.589100       1.627000      -1.161000    
 C    5.552100      0.2760000      -1.338400    
 H   -1.802900      -1.305600      0.8682000    
 H    1.218200       1.004900       2.387100    
 H    1.279600       2.754100       2.497200    
 H    2.890100      -1.682600     -0.6585000    
 H    3.495400       1.852900      -1.454500    
 H    3.004800      0.2353000      -1.982200    
 H    1.561500      -3.660200     -0.4443000    
 H   -1.682500     -9.3000000E-03  -1.740200    
 H   -2.766400       2.623400       1.519800    
 H   -3.911000      0.2893000      -2.706800    
 H   -4.986500       2.930800      0.5068000    
 H   -5.571400       1.764900      -1.603200    
 H    6.404500     -0.1370000     -0.7926000    
 H    5.808700       1.284800      -1.675800    
 H    5.342400     -0.3678000      -2.198200    


%chk=000065764-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065764

0 1
O 4.355009 -0.127028 -1.443608
O 3.106678 2.834629 0.006328
O -0.419060 -5.044774 0.370697
O -2.171837 -3.723361 0.997377
N 2.214212 0.738803 -0.536525
N -0.052880 2.118543 0.965140
N -0.965140 -3.890219 0.567345
C 1.387331 -0.386020 -0.226828
C 0.019573 -0.243323 0.191867
C -0.638090 1.091881 0.377233
C 2.299668 1.907125 0.273539
C -0.734092 -1.416274 0.447132
C 1.331932 1.945775 1.460019
C 1.936387 -1.688767 -0.419254
C 3.148786 0.644541 -1.693337
C -2.047427 1.281808 -0.087791
C -0.155517 -2.685113 0.276662
C 1.175502 -2.838511 -0.172855
C -2.586375 0.533309 -1.169702
C -2.857423 2.269292 0.537158
C -3.907707 0.763262 -1.610900
C -4.177296 2.492694 0.099326
C -4.708817 1.739257 -0.975805
C 5.330899 0.536901 -0.560758
H -1.773700 -1.345771 0.777672
H 1.456612 1.018513 2.061585
H 1.599644 2.818421 2.072613
H 2.978767 -1.770879 -0.742181
H 3.396168 1.683634 -1.977294
H 2.639892 0.110601 -2.509483
H 1.590824 -3.840894 -0.303862
H -1.969925 -0.213057 -1.682061
H -2.426035 2.850247 1.357819
H -4.309552 0.184136 -2.449235
H -4.794749 3.250128 0.594376
H -5.736368 1.912367 -1.314279
H 6.239944 -0.081502 -0.608697
H 4.964231 0.583005 0.482737
H 5.544429 1.564523 -0.909370


