%chk=000055150.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055150

0 1
 O   -2.430400     -0.2609000      -1.815800    
 O   0.1020000       2.835800      0.7840000    
 N    1.276400       1.433300     -0.6612000    
 C    3.434200       1.539800      0.5415000    
 C    2.558800       2.094900     -0.5796000    
 C   -1.023200       1.032500     -0.2168000    
 C   -1.158300      0.3466000      -1.538600    
 C   -3.089300      8.5600004E-02  0.5043000    
 C   -1.926200      0.9241000      0.7603000    
 C   -3.283600     -0.4663000     -0.7662000    
 C    3.756800      7.6099999E-02  0.3662000    
 C   0.1566000       1.863500      3.0200001E-02
 C   -4.028900     -0.1599000       1.512700    
 C   -4.411100      -1.249200      -1.027200    
 C    2.912900     -0.8768000      0.9151000    
 C    4.891900     -0.2901000     -0.3402000    
 C   -5.149700     -0.9499000       1.251600    
 C   -5.340900      -1.493200     -1.7400000E-02
 C    3.211400      -2.229800      0.7536000    
 C    5.190400      -1.643100     -0.5018000    
 C    4.350100      -2.612900      4.5100000E-02
 H    2.941400       1.688100       1.511300    
 H    4.367000       2.115500      0.5923000    
 H    2.394800       3.166300     -0.4201000    
 H    3.046800       1.969500      -1.552500    
 H  -0.9755000       1.059000      -2.351000    
 H  -0.4235000     -0.4612000      -1.626400    
 H   -1.828500       1.409800       1.724400    
 H    1.245300      0.6009000      -1.238200    
 H   -3.900400      0.2601000       2.507500    
 H   -4.570300      -1.673400      -2.015100    
 H    2.024500     -0.5904000       1.470800    
 H    5.551200      0.4576000     -0.7716000    
 H   -5.875300      -1.138200       2.037600    
 H   -6.215300      -2.104600     -0.2204000    
 H    2.557300      -2.984900       1.179800    
 H    6.076800      -1.941600      -1.054000    
 H    4.582500      -3.666300     -8.0899999E-02


%chk=000055150-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055150

0 1
O -2.249525 -0.887736 -1.402641
O 0.033708 2.821034 0.887379
N 1.317381 1.368762 -0.402502
C 3.542812 1.472578 0.779572
C 2.556118 2.138018 -0.227554
C -1.051455 0.845158 -0.021458
C -0.945720 -0.420511 -0.861448
C -3.411194 0.285047 0.430353
C -2.233932 1.126630 0.609120
C -3.382298 -0.710900 -0.592423
C 3.976687 0.082571 0.338886
C 0.119875 1.755147 0.193217
C -4.609573 0.455840 1.172217
C -4.516984 -1.492954 -0.885189
C 3.324316 -1.077022 0.834865
C 5.010869 -0.084023 -0.620369
C -5.744247 -0.337216 0.905727
C -5.695487 -1.305972 -0.128065
C 3.693087 -2.366703 0.385266
C 5.382810 -1.370027 -1.072104
C 4.722769 -2.517302 -0.571886
H 3.050595 1.433954 1.768177
H 4.421407 2.139689 0.872942
H 2.261572 3.133791 0.143957
H 3.050966 2.256389 -1.210358
H -0.335096 -0.273233 -1.769738
H -0.507318 -1.255806 -0.270860
H -2.285108 2.020220 1.242074
H 1.388857 0.471073 -0.883762
H -4.640823 1.222562 1.955521
H -4.463994 -2.230857 -1.691125
H 2.536624 -0.967037 1.590539
H 5.533784 0.800013 -1.007435
H -6.661333 -0.200241 1.487381
H -6.576652 -1.919494 -0.345700
H 3.183977 -3.250700 0.786104
H 6.188461 -1.478943 -1.807106
H 5.012763 -3.515499 -0.918271


