%chk=000062452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062452

0 1
 O    4.902800     -0.7444000      -1.220000    
 N    4.872300     -9.1100000E-02 -7.4999998E-03
 C    1.088600      0.6456000      4.3699998E-02
 C    2.386200     -0.1680000      1.6799999E-02
 C  -0.1706000     -0.2136000     -0.1110000    
 C    3.628400      0.7069000      0.1082000    
 C   -1.471300      0.5867000     -1.2600000E-02
 C   -2.694200     -0.3312000     -9.9500000E-02
 C   -3.994300      0.4643000      3.7500001E-02
 C   -5.252600     -0.4015000     -7.3500000E-02
 C    4.940200      -1.120400       1.093400    
 C    6.082100      0.8054000      8.4500000E-02
 C   -6.549600      0.3811000      0.1363000    
 C   -7.768100     -0.5199000      3.5999999E-03
 H    1.034400       1.200700      0.9885000    
 H    1.110900       1.390900     -0.7609000    
 H    2.345100     -0.8729000      0.8540000    
 H    2.406900     -0.7688000     -0.9001000    
 H  -0.1668000     -0.9888000      0.6656000    
 H  -0.1357000     -0.7333000      -1.076400    
 H    3.671400       1.242800       1.063300    
 H    3.651700       1.434200     -0.7120000    
 H   -1.506100       1.330800     -0.8172000    
 H   -1.491200       1.134700      0.9371000    
 H   -2.646100      -1.089300      0.6915000    
 H   -2.688000     -0.8626000      -1.058700    
 H   -4.028300       1.242400     -0.7352000    
 H   -3.998900      0.9799000       1.005900    
 H   -5.270900     -0.8792000      -1.061000    
 H   -5.197200      -1.209200      0.6671000    
 H    5.940700      -1.562600       1.064800    
 H    4.765600     -0.6162000       2.047100    
 H    4.203200      -1.901300      0.8948000    
 H    6.970300      0.1811000     -4.5400001E-02
 H    6.009400       1.539300     -0.7227000    
 H    6.071200       1.287400       1.065400    
 H   -6.547500      0.8434000       1.130100    
 H   -6.617000       1.191000     -0.5990000    
 H   -7.814700     -0.9728000     -0.9919000    
 H   -7.744700      -1.323500      0.7465000    
 H   -8.684800      5.8100000E-02  0.1570000    


%chk=000062452-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062452

0 1
O 4.752466 -0.557374 -1.419733
N 4.926514 -0.056582 -0.092352
C 1.093638 0.602068 0.233473
C 2.399215 -0.225731 0.246076
C -0.171617 -0.280991 0.149010
C 3.636689 0.667699 0.380790
C -1.482005 0.536728 0.108993
C -2.750864 -0.342092 0.036544
C -4.060530 0.477466 -0.002698
C -5.331785 -0.398824 -0.066616
C 5.265550 -1.211567 0.842995
C 6.070562 0.948130 -0.089184
C -6.640656 0.422939 -0.104173
C -7.906059 -0.459641 -0.165579
H 1.032726 1.237076 1.143056
H 1.112818 1.295045 -0.632878
H 2.352183 -0.965310 1.070262
H 2.519569 -0.776559 -0.707641
H -0.196802 -0.970681 1.018685
H -0.108526 -0.921602 -0.754591
H 3.791722 1.029749 1.416779
H 3.548077 1.531370 -0.300518
H -1.460272 1.220852 -0.765002
H -1.537160 1.184752 1.009146
H -2.773125 -1.026197 0.910740
H -2.697172 -0.990346 -0.863026
H -4.040625 1.157988 -0.879725
H -4.110777 1.129723 0.894589
H -5.284462 -1.050902 -0.963986
H -5.353120 -1.079588 0.810241
H 6.188776 -1.668269 0.458096
H 5.395390 -0.873585 1.888226
H 4.449553 -1.942006 0.765017
H 6.968631 0.416457 -0.435888
H 5.811081 1.726037 -0.821514
H 6.231361 1.386634 0.914068
H -6.686033 1.075303 0.791950
H -6.618575 1.101847 -0.981140
H -7.899293 -1.099360 -1.068385
H -7.967160 -1.126082 0.715571
H -8.827103 0.151526 -0.191582


