%chk=000007029.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007029

0 1
 O  -8.5299999E-02  -2.457400      0.3739000    
 N    1.572900      0.4184000     -0.2447000    
 C    1.290100     -0.5293000      0.8326000    
 C    1.702200     -0.2828000      -1.521500    
 C    2.788900       1.176500      4.7600001E-02
 C  -1.7899999E-02  -1.233800      0.4890000    
 C    2.423500      -1.541700      0.9332000    
 C    1.931900      0.6741000      -2.646000    
 C    2.677400       1.901500       1.349600    
 C   -1.253000     -0.4254000      0.2668000    
 C   -1.389500      0.7672000      0.9394000    
 C   -2.206700     -0.9046000     -0.6015000    
 C   -2.543900       1.522400      0.7321000    
 C   -3.360900     -0.1493000     -0.8088000    
 C   -3.529400       1.064200     -0.1421000    
 H    1.145800     -6.3800000E-02   1.812200    
 H    2.533600     -0.9951000      -1.545100    
 H   0.7939000     -0.8402000      -1.772300    
 H    3.711100      0.5873000      3.9999999E-04
 H    2.906000       1.967100     -0.7029000    
 H    3.400100      -1.103200       1.152300    
 H    2.216800      -2.206700       1.783500    
 H    2.517000      -2.215800      7.6300003E-02
 H    1.213600       1.501600      -2.634300    
 H    2.945100       1.088500      -2.654500    
 H    1.806400      0.1574000      -3.604800    
 H    1.726900       2.438500       1.444800    
 H    2.798000       1.243900       2.216200    
 H    3.473200       2.651900       1.424600    
 H  -0.6528000       1.144200       1.639200    
 H   -2.086100      -1.844200      -1.131800    
 H   -2.677400       2.465400       1.254200    
 H   -4.127900     -0.5052000      -1.490500    
 H   -4.428400       1.652000     -0.3031000    


%chk=000007029-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007029

0 1
O -0.089496 -2.541495 -0.086766
N 1.798956 0.346327 -0.265694
C 1.326505 -0.704663 0.688963
C 2.072046 -0.161380 -1.642087
C 2.914118 1.188050 0.249156
C -0.018177 -1.306970 0.191845
C 2.346504 -1.826563 0.999568
C 1.870187 0.919390 -2.722816
C 2.596720 1.931513 1.559638
C -1.243177 -0.440042 0.099616
C -1.216190 0.965319 0.314138
C -2.484873 -1.072715 -0.189026
C -2.408831 1.716843 0.247764
C -3.673736 -0.320496 -0.256011
C -3.639271 1.078250 -0.035655
H 1.084025 -0.177525 1.634237
H 3.103970 -0.582669 -1.722473
H 1.377850 -0.996593 -1.845716
H 3.853218 0.593418 0.382247
H 3.131987 1.939058 -0.532037
H 3.292820 -1.396606 1.374467
H 1.948563 -2.512069 1.767827
H 2.556021 -2.432325 0.102348
H 0.843269 1.320896 -2.671077
H 2.575539 1.762140 -2.607927
H 2.030362 0.487425 -3.728256
H 1.667234 2.521359 1.463447
H 2.488375 1.247323 2.420376
H 3.419835 2.629148 1.799359
H -0.254085 1.456834 0.481448
H -2.486056 -2.155789 -0.351321
H -2.380436 2.800371 0.408330
H -4.625069 -0.817363 -0.476105
H -4.563507 1.665199 -0.087807


