%chk=000014649.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014649

0 1
 N  -0.3784000      0.5145000      0.4913000    
 N    5.734100      -1.083700     -0.3961000    
 C   -2.885600      0.2109000      0.6941000    
 C   -3.025900     -8.7899998E-02 -0.8311000    
 C   -1.755800     -0.9628000     -0.9897000    
 C   -2.611600      -1.197800       1.291600    
 C   -1.867800      -1.963900      0.1828000    
 C   -1.636800       1.114100      0.9559000    
 C  -0.4674000     -0.1222000     -0.8277000    
 C   -4.117100      0.8582000       1.330600    
 C   -4.298900     -0.8949000      -1.193300    
 C   -3.047200       1.155400      -1.740500    
 C   0.7323000       1.456200      0.5655000    
 C    2.055400      0.7843000      0.3113000    
 C    2.335900     -0.4277000      0.9266000    
 C    2.975800       1.386700     -0.5348000    
 C    3.562000      -1.049900      0.6912000    
 C    4.201800      0.7644000     -0.7704000    
 C    4.495000     -0.4538000     -0.1573000    
 H   -1.730300      -1.485600      -1.952300    
 H   -3.542000      -1.721200       1.541600    
 H   -2.019200      -1.151800       2.212400    
 H  -0.8924000      -2.328200      0.5231000    
 H   -2.448700      -2.844100     -0.1160000    
 H   -1.790700       2.102000      0.5047000    
 H   -1.549400       1.286000       2.037200    
 H   0.3750000     -0.8068000     -0.9795000    
 H  -0.4068000      0.6186000      -1.633700    
 H   -4.334000       1.830500      0.8762000    
 H   -5.008500      0.2315000       1.226100    
 H   -3.961800       1.019400       2.403300    
 H   -4.452800      -1.778800     -0.5691000    
 H   -4.249900      -1.240300      -2.232700    
 H   -5.198200     -0.2760000      -1.097800    
 H   -3.028800      0.8579000      -2.795600    
 H   -2.206700       1.835600      -1.590500    
 H   -3.959000       1.741300      -1.578600    
 H   0.7853000       1.899900       1.568400    
 H   0.5767000       2.283800     -0.1394000    
 H    1.629200     -0.9021000       1.601700    
 H    2.759800       2.335600      -1.017200    
 H    3.779600      -1.997700       1.176900    
 H    4.920500       1.238800      -1.433700    
 H    6.411800     -0.6513000      -1.009700    
 H    5.947600      -1.966100      4.9600001E-02


%chk=000014649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014649

0 1
N -0.422294 0.578317 0.305731
N 5.867920 -1.159626 -0.139612
C -2.888051 0.210737 0.704613
C -3.126179 -0.076921 -0.835073
C -1.823472 -0.904507 -1.117308
C -2.481493 -1.200568 1.251428
C -1.796422 -1.937465 0.052495
C -1.666629 1.165489 0.857866
C -0.568611 -0.005505 -1.049708
C -4.093623 0.817859 1.446663
C -4.383116 -0.958505 -1.079432
C -3.291729 1.182472 -1.720519
C 0.743207 1.480284 0.437785
C 2.079956 0.772083 0.254213
C 2.345587 -0.460364 0.904553
C 3.110279 1.337263 -0.534664
C 3.590516 -1.103658 0.778196
C 4.366471 0.710091 -0.669960
C 4.627860 -0.525178 -0.011970
H -1.860172 -1.391343 -2.111228
H -3.376129 -1.746209 1.606574
H -1.791838 -1.098990 2.107673
H -0.759025 -2.226529 0.294260
H -2.346262 -2.855887 -0.223199
H -1.911855 2.157666 0.399866
H -1.498828 1.352897 1.938304
H 0.333517 -0.611387 -1.256402
H -0.610642 0.781011 -1.844953
H -4.362311 1.814379 1.046207
H -4.982734 0.167420 1.367680
H -3.867847 0.941868 2.523250
H -4.424119 -1.844628 -0.423446
H -4.390669 -1.316483 -2.127172
H -5.311925 -0.379412 -0.922197
H -3.400315 0.887149 -2.782121
H -2.445676 1.885967 -1.661015
H -4.206955 1.737908 -1.439221
H 0.689995 1.921717 1.454884
H 0.687454 2.340229 -0.280986
H 1.547768 -0.916555 1.502736
H 2.929576 2.285883 -1.056803
H 3.769684 -2.058018 1.290028
H 5.146185 1.170828 -1.289675
H 6.607083 -0.749522 -0.701964
H 6.051963 -2.041257 0.329023


