%chk=000133417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133417

0 1
 O    4.978100     -0.5444000     -0.4840000    
 N    7.924700       1.031100       1.067600    
 C   -1.125900       1.158000      4.4300001E-02
 C  -0.5923000     -0.1089000     -4.2500000E-02
 C  -0.3480000       2.464700      9.3000002E-02
 C   0.8970000     -0.2262000     -0.1606000    
 C   -2.593900       1.346600      0.1589000    
 C   -1.429300      -1.298300     -1.7899999E-02
 C    1.453700     -0.2373000      -1.415800    
 C    1.638400     -0.3163000      0.9918000    
 C  -9.0400003E-02   3.047800      -1.291300    
 C   -3.165800       1.386000       1.414400    
 C   -3.342200       1.476400     -0.9935000    
 C   -1.738400      -1.908700       1.197600    
 C   -1.922800      -1.828500      -1.210000    
 C    3.625500     -0.4392000     -0.3770000    
 C    2.840000     -0.3456000      -1.525900    
 C    3.024700     -0.4244000      0.8818000    
 C   -4.545200       1.563000       1.521900    
 C   -4.721500       1.653600     -0.8858000    
 C   -2.541000      -3.049300       1.220900    
 C   -2.725500      -2.969100      -1.186600    
 C   -5.323100       1.697000      0.3718000    
 C   -3.034700      -3.579500      2.8999999E-02
 C    5.758200      2.2000000E-03  0.5783000    
 C    7.099600      0.4492000      1.9500000E-02
 H   0.6109000       2.326900      0.6045000    
 H  -0.8843000       3.206000      0.6995000    
 H   0.8503000     -0.1675000      -2.316000    
 H    1.178500     -0.3101000       1.975600    
 H   0.4620000       2.358500      -1.934200    
 H   0.4991000       3.966600      -1.203900    
 H   -1.027600       3.304000      -1.795500    
 H   -2.569300       1.284200       2.316700    
 H   -2.885300       1.442200      -1.978500    
 H   -1.362700      -1.508800       2.136400    
 H   -1.692100      -1.365300      -2.166400    
 H    3.302300     -0.3566000      -2.509100    
 H    3.596300     -0.5224000       1.800000    
 H   -5.013700       1.596600       2.501200    
 H   -5.327300       1.756900      -1.781300    
 H   -2.782100      -3.524400       2.167400    
 H   -3.110200      -3.381600      -2.114700    
 H   -3.660000      -4.467300      4.7300000E-02
 H   -6.397100       1.834500      0.4556000    
 H    5.266500      0.8764000       1.026000    
 H    5.903000     -0.7671000       1.346300    
 H    7.618400     -0.4049000     -0.4300000    
 H    6.946400       1.177600     -0.7851000    
 H    7.458400       1.848200       1.459700    
 H    8.797900       1.367500      0.6638000    


%chk=000133417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133417

0 1
O 5.085225 0.395068 -0.640863
N 8.363101 -0.804664 0.645723
C -1.404370 1.405170 0.120060
C -0.627191 0.258077 0.069380
C -0.803031 2.804361 0.251961
C 0.863157 0.298422 -0.091475
C -2.902159 1.368025 0.045674
C -1.208678 -1.119155 0.230663
C 1.490887 1.066512 -1.115127
C 1.703443 -0.478629 0.749595
C -1.095074 3.742211 -0.948176
C -3.708804 2.142191 0.926447
C -3.561730 0.608290 -0.962065
C -2.136099 -1.412690 1.268370
C -0.796036 -2.182411 -0.619899
C 3.705627 0.313716 -0.405963
C 2.887190 1.077740 -1.275111
C 3.107583 -0.472680 0.611620
C -5.117172 2.135437 0.824261
C -4.967575 0.606975 -1.072564
C -2.651385 -2.715322 1.434787
C -1.318075 -3.484520 -0.461848
C -5.755846 1.367459 -0.176697
C -2.250620 -3.757952 0.566445
C 5.980984 -0.378100 0.237726
C 7.415454 -0.100961 -0.235073
H 0.284655 2.735962 0.418907
H -1.226263 3.278023 1.162417
H 0.868921 1.643533 -1.807798
H 1.247895 -1.096356 1.531519
H -0.659074 3.344272 -1.882727
H -0.664922 4.745143 -0.771115
H -2.181617 3.858017 -1.108647
H -3.234395 2.740633 1.712931
H -2.959058 0.021268 -1.662923
H -2.445704 -0.611827 1.947953
H -0.064172 -1.980010 -1.410237
H 3.364573 1.661814 -2.068021
H 3.716715 -1.079741 1.287815
H -5.715234 2.729584 1.524956
H -5.448716 0.014818 -1.859420
H -3.362468 -2.918428 2.243746
H -0.995401 -4.285471 -1.137052
H -2.652208 -4.769650 0.694381
H -6.848455 1.365444 -0.260721
H 5.846407 -0.054059 1.291355
H 5.760820 -1.460920 0.167233
H 7.527491 -0.488712 -1.263142
H 7.566147 1.000317 -0.287649
H 8.541353 -0.357044 1.547254
H 9.212105 -1.149181 0.196332


