%chk=000064216.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064216

0 1
 O   0.7918000      7.6700002E-02  -1.286600    
 O    5.597100      0.9944000      0.3724000    
 N  -0.2462000     -0.9220000      0.5350000    
 N    3.250200     -0.5086000     -0.2056000    
 C   -1.581100     -0.4165000      0.2936000    
 C   -3.505200     -0.3555000      -1.344800    
 C   -3.965000     -0.3877000       1.134100    
 C   -2.985600       1.672900      6.0199998E-02
 C   -2.086600     -0.8947000      -1.085100    
 C   -2.545200     -0.9269000       1.387000    
 C   -1.568300       1.128600      0.3161000    
 C   -4.450400     -0.8671000     -0.2445000    
 C   -3.476000       1.182100      -1.312700    
 C   -3.933400       1.150100       1.153200    
 C   0.8349000     -0.6301000     -0.2820000    
 C    2.099400      -1.317800      0.1903000    
 C    3.176800      0.8312000      0.3935000    
 C    4.507100      -1.164800      0.1808000    
 C    4.393300       1.652300     -2.4300000E-02
 C    5.692600     -0.2965000     -0.2309000    
 H   -3.857900     -0.6989000      -2.323700    
 H   -4.643200     -0.7536000       1.913000    
 H   -2.970000       2.768300      7.8199998E-02
 H   -2.092600      -1.992100      -1.126100    
 H   -1.436900     -0.5626000      -1.901800    
 H   -2.198000     -0.6109000       2.379600    
 H   -2.560500      -2.024700       1.400100    
 H  -0.8967000       1.548200     -0.4404000    
 H   -1.200400       1.489900       1.285700    
 H   -4.492400      -1.963000     -0.2665000    
 H   -5.469600     -0.5057000     -0.4288000    
 H   -2.816700       1.560900      -2.103200    
 H   -4.478000       1.579600      -1.516000    
 H   -3.603100       1.505700       2.136900    
 H   -4.943500       1.547100      0.9937000    
 H  -0.1068000      -1.534600       1.333500    
 H    2.131600      -2.300000     -0.2959000    
 H    2.073000      -1.471700       1.276100    
 H    3.155600      0.7522000       1.488800    
 H    2.289600       1.391800      8.5600004E-02
 H    4.592900      -2.140500     -0.3107000    
 H    4.533900      -1.327000       1.266300    
 H    4.411000       1.828600      -1.106800    
 H    4.371600       2.628900      0.4700000    
 H    6.626400     -0.7548000      0.1102000    
 H    5.755300     -0.1876000      -1.320500    


%chk=000064216-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064216

0 1
O 0.830247 0.370987 -1.151881
O 5.992985 0.779213 0.173016
N -0.267040 -0.703004 0.610479
N 3.372590 -0.432513 -0.044944
C -1.661526 -0.282973 0.296645
C -3.557032 -0.388490 -1.396363
C -4.072653 -0.508622 1.082490
C -3.273513 1.669446 0.061255
C -2.086355 -0.795896 -1.110922
C -2.598651 -0.911426 1.365665
C -1.801833 1.267435 0.350962
C -4.486946 -1.018807 -0.324832
C -3.681833 1.159080 -1.347881
C -4.204663 1.038031 1.131254
C 0.854000 -0.388169 -0.137424
C 2.136588 -1.098379 0.367952
C 3.533542 0.933878 0.507535
C 4.578758 -1.260046 0.191662
C 4.788521 1.589552 -0.088993
C 5.812774 -0.562071 -0.404811
H -3.844411 -0.753677 -2.401826
H -4.724513 -0.964810 1.853306
H -3.359619 2.773249 0.096512
H -1.979579 -1.898963 -1.141393
H -1.407627 -0.370926 -1.871298
H -2.300219 -0.563210 2.376638
H -2.500238 -2.016908 1.345423
H -1.118146 1.716789 -0.390668
H -1.494114 1.624912 1.354316
H -4.419637 -2.124781 -0.365345
H -5.542449 -0.747499 -0.526596
H -3.029804 1.615078 -2.118526
H -4.723708 1.463127 -1.573600
H -3.934914 1.412928 2.139452
H -5.256770 1.332077 0.943993
H -0.134914 -1.285782 1.441823
H 2.136040 -2.119693 -0.064061
H 2.060918 -1.224738 1.484442
H 3.623646 0.914545 1.624522
H 2.647573 1.532612 0.232391
H 4.443333 -2.245113 -0.295905
H 4.756489 -1.436783 1.284247
H 4.651970 1.712742 -1.184181
H 4.986313 2.569144 0.376392
H 6.736867 -1.114994 -0.167000
H 5.694353 -0.482951 -1.506919


