%chk=000090766.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090766

0 1
 O   -3.825700     -0.3837000      0.4000000    
 N    3.935900      0.3924000     -0.2811000    
 C    2.561100      0.1830000      0.1825000    
 C    1.599400      0.2360000      -1.018800    
 C   0.1475000      7.0299998E-02 -0.6389000    
 C    2.501200      -1.153500      0.9221000    
 C  -0.4034000      -1.200300     -0.6023000    
 C  -0.6064000       1.192100     -0.3341000    
 C    4.857500      0.4091000      0.8426000    
 C   -1.744800      -1.353400     -0.2516000    
 C   -1.947800       1.039000      1.6700000E-02
 C   -2.517000     -0.2338000      5.8100000E-02
 C   -4.557500      0.8028000      0.7047000    
 H    2.282500      0.9836000      0.8811000    
 H    1.868100     -0.5362000      -1.753500    
 H    1.718600       1.191000      -1.549300    
 H    3.121100      -1.169900       1.824000    
 H    2.806600      -1.986500      0.2787000    
 H    1.491200      -1.363900       1.285500    
 H    3.986400       1.287700     -0.7673000    
 H   0.1861000      -2.079100     -0.8476000    
 H  -0.1702000       2.186600     -0.3615000    
 H    5.816400      0.8155000      0.5018000    
 H    5.078300     -0.5950000       1.216600    
 H    4.513600       1.048400       1.662600    
 H   -2.183000      -2.347300     -0.2226000    
 H   -2.489400       1.950500      0.2457000    
 H   -4.150900       1.311100       1.585700    
 H   -5.578800      0.4974000      0.9549000    
 H   -4.625900       1.467300     -0.1632000    


%chk=000090766-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090766

0 1
O -3.949493 -0.343662 0.282822
N 3.978868 0.368055 -0.237427
C 2.595093 0.117684 0.238569
C 1.666418 0.065404 -1.011390
C 0.185248 -0.013238 -0.677897
C 2.525088 -1.189435 1.053734
C -0.536302 -1.231508 -0.798422
C -0.519775 1.125728 -0.217806
C 4.989097 0.629991 0.805405
C -1.903348 -1.312309 -0.472178
C -1.892538 1.068775 0.116307
C -2.586733 -0.159812 -0.011920
C -4.699023 0.820976 0.755504
H 2.232787 0.952815 0.895406
H 1.977165 -0.799900 -1.626385
H 1.861874 0.976423 -1.616423
H 3.117890 -1.122892 1.983535
H 2.920364 -2.027342 0.450506
H 1.481259 -1.411291 1.336384
H 3.986359 1.101951 -0.959208
H -0.017867 -2.129027 -1.156622
H 0.008653 2.083182 -0.124932
H 5.939006 0.927402 0.326233
H 5.189955 -0.287899 1.385783
H 4.700159 1.431067 1.530808
H -2.460448 -2.249422 -0.567980
H -2.401566 1.973105 0.463929
H -4.287245 1.207783 1.708500
H -5.724660 0.457321 0.916581
H -4.705584 1.631275 0.000085


