%chk=000162157.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162157

1 1
 O   -2.522600      -1.565700      0.3593000    
 N    2.546500      0.7826000      9.1700003E-02
 C    2.135500     -0.2848000       1.095800    
 C    1.326300       1.599200     -0.3087000    
 C    3.138800      0.1170000      -1.142200    
 C    3.585500       1.698800      0.7219000    
 C    1.108900      -1.236100      0.5553000    
 C   0.7422000       2.258300      0.9217000    
 C    3.545400       1.182600      -2.136400    
 C    4.795800      0.8817000       1.117900    
 C  -0.2431000     -0.9520000      0.7118000    
 C    1.519100      -2.392800     -9.7900003E-02
 C   -1.197300      -1.836200      0.2086000    
 C   0.5649000      -3.277100     -0.6010000    
 C  -0.7933000      -2.998800     -0.4478000    
 C   -2.950900     -0.2763000      9.1399997E-02
 C   -2.494600      0.3611000      -1.048000    
 C   -3.823000      0.3404000      0.9699000    
 C   -2.925400       1.659900      -1.318200    
 C   -4.253800       1.639300      0.6996000    
 C   -3.805000       2.299000     -0.4444000    
 H    1.840200      0.1658000       2.047900    
 H    3.018400     -0.8903000       1.326300    
 H    1.637700       2.403500     -0.9807000    
 H   0.6148000      0.9682000     -0.8461000    
 H    3.956500     -0.5540000     -0.8689000    
 H    2.356300     -0.4784000      -1.622300    
 H    3.821800       2.530700      5.3900000E-02
 H    3.164400       2.121200       1.639900    
 H  -0.2308000       2.685300      0.6475000    
 H   0.5561000       1.635800       1.793700    
 H    1.343400       3.115100       1.244700    
 H    3.972500      0.6746000      -3.011100    
 H    2.715500       1.769700      -2.534900    
 H    4.334900       1.849800      -1.785400    
 H    5.533800       1.571400       1.548500    
 H    4.608400      0.1508000       1.907400    
 H    5.312700      0.4023000      0.2847000    
 H  -0.5633000     -8.2500003E-02   1.272600    
 H    2.572400      -2.631300     -0.2170000    
 H   0.8793000      -4.183500      -1.110100    
 H   -1.532000      -3.691600     -0.8416000    
 H   -1.828000     -0.1228000      -1.755800    
 H   -4.172600     -0.1719000       1.861100    
 H   -2.579300       2.172200      -2.211200    
 H   -4.938400       2.137000       1.380100    
 H   -4.140900       3.310100     -0.6552000    


%chk=000162157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162157

1 1
O -2.597317 -1.369519 -0.758052
N 2.730307 0.783439 0.031523
C 1.952153 -0.176423 1.012976
C 1.738556 1.672970 -0.761305
C 3.528181 -0.083474 -0.975353
C 3.668240 1.682988 0.875905
C 0.987752 -1.143054 0.358750
C 0.946680 2.693652 0.065930
C 4.458885 0.683364 -1.923419
C 4.844184 0.969374 1.555474
C -0.357320 -0.754447 0.121005
C 1.401704 -2.463316 0.046875
C -1.265588 -1.676196 -0.450729
C 0.482332 -3.375152 -0.523851
C -0.846642 -2.989329 -0.780310
C -3.184006 -0.148889 -0.288372
C -3.631260 0.769881 -1.258165
C -3.400678 0.057788 1.091470
C -4.306628 1.936987 -0.830554
C -4.072550 1.230906 1.504269
C -4.522723 2.172289 0.547545
H 1.440852 0.494705 1.722220
H 2.740616 -0.721118 1.555429
H 2.339615 2.196137 -1.522320
H 1.060263 0.971856 -1.274571
H 4.102442 -0.803222 -0.368956
H 2.772483 -0.654868 -1.538950
H 4.032218 2.471894 0.195864
H 3.027529 2.161253 1.634677
H 0.214875 3.170825 -0.609712
H 0.368862 2.241380 0.889180
H 1.577387 3.499173 0.475704
H 4.994727 -0.063410 -2.535837
H 3.922168 1.340485 -2.627270
H 5.224794 1.276105 -1.396369
H 5.415010 1.731019 2.115814
H 4.527956 0.209548 2.289445
H 5.543954 0.505782 0.841177
H -0.710920 0.244372 0.396939
H 2.424044 -2.791322 0.268685
H 0.800613 -4.395821 -0.757596
H -1.572631 -3.681662 -1.215899
H -3.474247 0.554820 -2.319411
H -3.080003 -0.694759 1.819599
H -4.673997 2.652023 -1.574016
H -4.263477 1.396885 2.569737
H -5.055691 3.071386 0.873126


