%chk=000054841.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054841

0 1
 O  -0.7732000     -6.0000003E-04 -0.8342000    
 N    2.655700       3.347100      1.6100001E-02
 C   0.3337000      0.2985000      1.8800000E-02
 C   0.9347000       1.651600     -0.3951000    
 C    1.307500     -0.8540000     -6.0300000E-02
 C    2.143900       2.051800      0.4507000    
 C   -1.995200     -0.1129000     -0.2317000    
 C    1.412400      -1.573100      -1.239700    
 C    2.076900      -1.169100       1.047800    
 C   -3.044400      0.7281000     -0.5941000    
 C    2.311500      -2.637000      -1.313100    
 C    2.976100      -2.232900      0.9743000    
 C   -2.178500      -1.081900      0.7518000    
 C    3.093300      -2.966900     -0.2061000    
 C    3.783300       3.761500      0.8384000    
 C   -4.284700      0.5993000      3.0800000E-02
 C   -2.862200       1.771300      -1.646800    
 C   -3.418800      -1.210700       1.376500    
 C   -4.471900     -0.3702000       1.016200    
 H  -3.5999999E-03  0.3992000       1.061000    
 H   0.1539000       2.420300     -0.3238000    
 H    1.217100       1.615800      -1.456400    
 H    2.944800       1.314700      0.3381000    
 H    1.853300       2.090800       1.507400    
 H   0.8274000      -1.327600      -2.121100    
 H    1.991100     -0.6084000       1.973900    
 H    1.916600       4.046500      8.1299998E-02
 H    2.405700      -3.206400      -2.233200    
 H    3.584300      -2.490500       1.836400    
 H   -1.373900      -1.753800       1.036600    
 H    3.793900      -3.794800     -0.2634000    
 H    4.153600       4.729700      0.4872000    
 H    4.610700       3.048100      0.7667000    
 H    3.495900       3.872800       1.889000    
 H   -5.114900       1.247200     -0.2375000    
 H   -2.224100       2.578100      -1.272800    
 H   -2.406400       1.339800      -2.544300    
 H   -3.817600       2.211800      -1.951900    
 H   -3.565500      -1.967300       2.141800    
 H   -5.437700     -0.4709000       1.502600    


%chk=000054841-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054841

0 1
O -0.910548 0.906976 -0.444023
N 3.188115 3.440713 0.128005
C 0.355860 0.819616 0.324180
C 1.180213 2.024772 -0.176362
C 1.063742 -0.515738 0.105653
C 2.490499 2.231913 0.607323
C -2.036524 0.176392 -0.006494
C 1.088889 -1.109593 -1.180444
C 1.742760 -1.152396 1.173045
C -3.219301 0.401334 -0.771668
C 1.782867 -2.320059 -1.394168
C 2.443778 -2.361266 0.960045
C -2.037021 -0.702217 1.102205
C 2.465208 -2.948820 -0.325604
C 4.489595 3.694151 0.771432
C -4.395210 -0.278961 -0.383226
C -3.192112 1.346363 -1.955704
C -3.231552 -1.366376 1.465438
C -4.415039 -1.157508 0.727037
H 0.129721 0.954138 1.404325
H 0.541555 2.925997 -0.084961
H 1.414538 1.893376 -1.247799
H 3.162566 1.366395 0.450996
H 2.266428 2.266920 1.707688
H 0.547073 -0.626664 -2.001326
H 1.722901 -0.703605 2.175043
H 2.574483 4.266132 0.152837
H 1.790374 -2.775805 -2.390731
H 2.965041 -2.845258 1.793736
H -1.121783 -0.896120 1.666986
H 3.002866 -3.888948 -0.492240
H 4.929469 4.623640 0.368524
H 5.184324 2.867090 0.533779
H 4.445838 3.784260 1.885476
H -5.311504 -0.113258 -0.962906
H -2.881097 2.362046 -1.648844
H -2.459076 1.016012 -2.714872
H -4.185342 1.410803 -2.432091
H -3.226875 -2.049703 2.322041
H -5.341018 -1.671744 1.005569


