%chk=000012645.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012645

0 1
 O   0.9134000       1.065800      0.8562000    
 N    3.444800      0.2978000      7.2200000E-02
 N   8.8699996E-02 -0.9863000      6.8200000E-02
 C    2.446600     -0.7307000      0.3632000    
 C    3.134300      0.9690000      -1.189400    
 C    4.783600     -0.2889000      2.3000000E-02
 C   -1.309200     -0.7707000      2.2399999E-02
 C    1.074700     -8.7499999E-02  0.4700000    
 C   -3.176500      0.6961000      0.3753000    
 C   -2.156500      -1.779900     -0.4066000    
 C   -1.801400      0.4647000      0.4140000    
 C    4.161900       2.041700      -1.508000    
 C    5.147500     -0.9381000       1.347500    
 C   -3.722100       2.019600      0.7933000    
 C   -4.041400     -0.3104000     -5.4400001E-02
 C   -3.531400      -1.548300     -0.4453000    
 C   -1.638600      -3.115800     -0.8304000    
 C   -3.818500       3.002000     -0.3711000    
 H    2.454800      -1.517000     -0.4017000    
 H    2.607200      -1.198200       1.340400    
 H    3.088800      0.2562000      -2.023300    
 H    2.165600       1.476700      -1.154800    
 H    4.882300      -1.020600     -0.7887000    
 H    5.543300      0.4833000     -0.1346000    
 H   0.4001000      -1.909600     -0.2197000    
 H   -1.193200       1.288700      0.7540000    
 H    4.355200       2.689800     -0.6463000    
 H    5.109000       1.625000      -1.864500    
 H    3.784000       2.680100      -2.315000    
 H    4.940300     -0.2757000       2.195100    
 H    4.629000      -1.888900       1.504000    
 H    6.220200      -1.162300       1.363700    
 H   -4.715200       1.889500       1.241400    
 H   -3.096800       2.452200       1.584300    
 H   -5.114400     -0.1417000     -9.0800002E-02
 H   -4.219700      -2.320900     -0.7776000    
 H  -0.9615000      -3.013300      -1.685100    
 H   -1.114200      -3.605900     -3.3000000E-03
 H   -2.448600      -3.785500      -1.140100    
 H   -2.834300       3.188800     -0.8140000    
 H   -4.223400       3.958500     -2.5800001E-02
 H   -4.475400       2.618800      -1.159300    


%chk=000012645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012645

0 1
O 0.951408 1.048898 0.804538
N 3.565148 0.086672 -0.115257
N 0.052335 -0.931536 -0.094762
C 2.475475 -0.822507 0.245023
C 3.430738 0.639849 -1.487959
C 4.910369 -0.461562 0.187536
C -1.354280 -0.696004 -0.056327
C 1.100392 -0.115547 0.340579
C -3.304906 0.699870 0.500818
C -2.207325 -1.727977 -0.562955
C -1.903824 0.502082 0.466899
C 4.192521 1.964391 -1.681551
C 5.205903 -0.558811 1.696896
C -3.878156 2.010082 1.023440
C -4.152451 -0.319850 0.003732
C -3.602217 -1.510971 -0.518997
C -1.641047 -3.021852 -1.126114
C -3.967203 3.095814 -0.083164
H 2.391663 -1.702560 -0.455066
H 2.682163 -1.242881 1.247477
H 3.752745 -0.104481 -2.262468
H 2.356827 0.836829 -1.660704
H 5.066110 -1.463297 -0.293824
H 5.651189 0.219946 -0.265884
H 0.336990 -1.832346 -0.486479
H -1.224209 1.270012 0.843884
H 3.852982 2.699166 -0.932169
H 5.285890 1.842556 -1.577879
H 3.998984 2.370501 -2.691773
H 5.045519 0.422391 2.175479
H 4.564134 -1.298690 2.209240
H 6.255128 -0.867632 1.859724
H -4.888606 1.837153 1.441219
H -3.248847 2.392481 1.849261
H -5.240424 -0.184907 0.027471
H -4.268841 -2.295089 -0.898097
H -0.982887 -2.847242 -2.001708
H -1.057244 -3.589423 -0.372647
H -2.454628 -3.684207 -1.465021
H -2.966830 3.313850 -0.498422
H -4.386037 4.036454 0.319711
H -4.611652 2.758475 -0.915301


