%chk=000023153.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023153

0 1
 O  -0.2947000      -2.914800      -1.700700    
 O    1.656800      -2.485900     -0.6581000    
 N    4.511500       1.091100     -0.2056000    
 C  -0.3604000      -1.367200      0.1995000    
 C   -1.345800      -2.290600       1.032700    
 C   0.6931000     -0.6700000       1.144800    
 C   -1.039600     -0.2192000     -0.5937000    
 C    1.747500      0.2034000      0.4449000    
 C   0.4492000      -2.291500     -0.7502000    
 C   -2.432600      -2.986700      0.1931000    
 C  -0.6360000      -3.376200       1.863000    
 C    2.692500      0.9092000       1.426300    
 C   -1.807700      0.7143000      6.4499997E-02
 C  -0.8110000     -0.2263000      -1.945700    
 C    3.691500       1.840800      0.7405000    
 C   -2.399800       1.736000     -0.7156000    
 C   -1.393100      0.7786000      -2.712700    
 C   -2.024900      0.6966000       1.451900    
 C   -2.182600       1.754100      -2.103000    
 C   -3.191600       2.709800     -8.5299999E-02
 C   -2.814600       1.671900       2.061400    
 C   -3.397000       2.676500       1.294200    
 C    5.408400       1.989600     -0.9337000    
 C    5.280600      5.6699999E-02  0.4876000    
 H   -1.913900      -1.734400       1.770500    
 H    1.262900      -1.455600       1.660200    
 H   0.2676000     -9.0400003E-02   1.960900    
 H    2.341400     -0.3760000     -0.2626000    
 H    1.250600      0.9861000     -0.1393000    
 H   -3.218800      -3.376300      0.8512000    
 H   -2.915200      -2.294600     -0.5028000    
 H   -2.047900      -3.844000     -0.3662000    
 H   3.5000001E-03  -2.937000       2.633900    
 H  -2.6100000E-02  -4.036600       1.239100    
 H   -1.369000      -4.003500       2.383900    
 H    3.187900      0.1782000       2.074500    
 H    2.084400       1.524600       2.103100    
 H  -0.1500000     -0.8763000      -2.498300    
 H    4.305900       2.342600       1.499200    
 H    3.130800       2.621600      0.2113000    
 H   -1.217900      0.8173000      -3.784100    
 H   -1.606900      7.4000000E-03   2.162700    
 H   -2.624000       2.532700      -2.721600    
 H   0.2520000      -3.500200      -2.266900    
 H   -3.656000       3.504700     -0.6652000    
 H   -2.969100       1.653900       3.136600    
 H   -4.009900       3.436800       1.769600    
 H    6.109600       2.503900     -0.2664000    
 H    5.986300       1.435100      -1.681500    
 H    4.834600       2.745800      -1.481100    
 H    4.647100     -0.7604000      0.8453000    
 H    5.988100     -0.4172000     -0.2039000    
 H    5.857900      0.4579000       1.328700    


%chk=000023153-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023153

0 1
O -0.225231 -3.106429 -1.470141
O 1.759768 -2.681624 -0.391658
N 4.476043 1.241222 -0.227530
C -0.269138 -1.407428 0.330075
C -1.280743 -2.331694 1.170825
C 0.751907 -0.722020 1.311020
C -0.958388 -0.316986 -0.544984
C 1.722930 0.289456 0.661392
C 0.548212 -2.399812 -0.528837
C -2.598772 -2.662543 0.436141
C -0.613433 -3.634272 1.689621
C 2.839659 0.712681 1.638690
C -1.848425 0.697102 0.008774
C -0.634256 -0.223473 -1.907753
C 3.840903 1.715836 1.026212
C -2.386119 1.724951 -0.874147
C -1.157987 0.788341 -2.765205
C -2.243036 0.773366 1.391090
C -2.029230 1.746806 -2.260471
C -3.270729 2.729936 -0.357241
C -3.100971 1.766345 1.868885
C -3.628917 2.758988 0.989213
C 5.253239 2.310849 -0.882397
C 5.268510 0.007619 -0.055460
H -1.532693 -1.746026 2.074813
H 1.346415 -1.517958 1.796694
H 0.182500 -0.210851 2.109884
H 2.192487 -0.144524 -0.238533
H 1.170465 1.188599 0.325781
H -3.239902 -3.285664 1.088022
H -3.163647 -1.751753 0.175771
H -2.401026 -3.222000 -0.493440
H 0.353395 -3.446082 2.188566
H -0.445152 -4.360147 0.873492
H -1.282446 -4.117025 2.425295
H 3.376079 -0.187807 1.999437
H 2.397266 1.187900 2.539035
H 0.042125 -0.953627 -2.356616
H 4.614186 1.972200 1.800848
H 3.303809 2.654863 0.785365
H -0.864880 0.799198 -3.820441
H -1.869270 0.038695 2.103620
H -2.445836 2.529603 -2.905185
H 0.369176 -3.769448 -1.918836
H -3.659705 3.484499 -1.051758
H -3.371475 1.782395 2.930615
H -4.303582 3.532261 1.372135
H 6.126208 2.665642 -0.274142
H 5.640771 1.950095 -1.852478
H 4.599726 3.180538 -1.076841
H 4.620665 -0.824250 0.269503
H 5.714504 -0.277942 -1.025085
H 6.099645 0.117694 0.689265


