%chk=000140081.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140081

0 1
 O   5.2900001E-02  -1.445800      0.4142000    
 O   -3.332200      0.7885000      -2.165100    
 N    3.222600      0.4171000      0.5067000    
 C   -1.327800      -1.096000      0.4247000    
 C   -3.131000      0.1206000     -0.9184000    
 C   -1.633700     -0.1844000     -0.7661000    
 C   -2.153200      -2.379200      0.3693000    
 C   -3.958300      -1.175200     -0.9223000    
 C   -3.646300      -2.088800      0.2634000    
 C   0.8805000     -0.2928000      0.4643000    
 C    2.335000     -0.7355000      0.4731000    
 C    3.010400       1.269100     -0.6661000    
 C    4.622800     -8.8000000E-03  0.5750000    
 C   -3.589300       1.029200      0.1484000    
 C    3.285900      0.4853000      -1.946200    
 C    3.910200       2.497100     -0.5711000    
 C    4.978100     -0.8560000     -0.6437000    
 C    4.855100     -0.7841000       1.867900    
 C   -3.963100       1.769300       1.017100    
 C   -4.418400       2.670500       2.074700    
 H   -1.547400     -0.5779000       1.367300    
 H   -1.125100      0.7833000     -0.6835000    
 H   -1.247100     -0.6354000      -1.691000    
 H   -1.951000      -2.988400       1.258600    
 H   -1.831400      -2.988600     -0.4854000    
 H   -3.762900      -1.722000      -1.855000    
 H   -5.031900     -0.9462000     -0.9390000    
 H   -4.195500      -3.030700      0.1528000    
 H   -3.997600      -1.627200       1.193900    
 H   0.7107000      0.2724000     -0.4464000    
 H   0.6423000      0.3143000       1.345500    
 H    2.437800      -1.321100       1.394800    
 H    2.469000      -1.470000     -0.3230000    
 H    1.997700       1.681600     -0.6787000    
 H    5.305300      0.8441000      0.6434000    
 H   -2.750300       1.567700      -2.191300    
 H    2.638700      0.9738000      -2.696200    
 H    4.258000      0.6596000      -2.411400    
 H    2.926700     -0.5396000      -2.033800    
 H    3.849500       2.967600      0.4170000    
 H    3.579000       3.247600      -1.299500    
 H    4.961100       2.297500     -0.8036000    
 H    5.811100      -1.505300     -0.3232000    
 H    4.279600      -1.605700      -1.011400    
 H    5.485100     -0.2969000      -1.431300    
 H    4.439200     -0.2572000       2.734400    
 H    5.931800     -0.8894000       2.048600    
 H    4.447300      -1.800100       1.843800    
 H   -5.347100       2.305700       2.523600    
 H   -3.667700       2.751600       2.866600    
 H   -4.603700       3.673400       1.678500    


%chk=000140081-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000140081

0 1
O -0.029101 -1.372379 -0.324163
O -4.183354 0.863178 -1.881859
N 3.343999 0.239940 -0.144944
C -1.427278 -1.063552 0.030688
C -3.577410 0.141434 -0.725528
C -2.065614 -0.104599 -1.003687
C -2.184222 -2.400701 0.073103
C -4.326233 -1.213276 -0.677007
C -3.691879 -2.180990 0.347289
C 0.925464 -0.312112 0.028243
C 2.327311 -0.803844 -0.377199
C 3.514516 1.213336 -1.257173
C 4.524302 -0.117752 0.684459
C -3.769036 0.929115 0.516051
C 4.513091 0.770406 -2.367615
C 3.864888 2.627962 -0.737009
C 5.307812 -1.382763 0.219176
C 4.119153 -0.258760 2.173071
C -3.931390 1.610697 1.533504
C -4.138844 2.421512 2.743082
H -1.451849 -0.586761 1.037254
H -1.528398 0.863354 -1.016430
H -1.979818 -0.560570 -2.008355
H -1.734518 -3.049037 0.847000
H -2.043196 -2.908456 -0.901652
H -4.274781 -1.643929 -1.695642
H -5.389859 -1.029544 -0.444971
H -4.222718 -3.150722 0.314226
H -3.830232 -1.776297 1.369745
H 0.686026 0.633562 -0.504813
H 0.894123 -0.109397 1.120587
H 2.559851 -1.705385 0.216821
H 2.287729 -1.133444 -1.439672
H 2.514341 1.285416 -1.731642
H 5.217650 0.742851 0.613762
H -3.843990 1.795771 -1.874181
H 4.475916 1.468688 -3.225189
H 5.551676 0.760294 -1.988213
H 4.268709 -0.241409 -2.740683
H 3.134334 2.945022 0.027481
H 3.854419 3.358544 -1.567348
H 4.873461 2.659705 -0.284006
H 6.209425 -1.524202 0.844740
H 4.690886 -2.295529 0.317994
H 5.628057 -1.298019 -0.833254
H 3.636180 0.668645 2.526547
H 5.002237 -0.466921 2.806431
H 3.404081 -1.092015 2.311150
H -4.395532 1.784212 3.609277
H -3.232039 2.997161 3.004745
H -4.966948 3.140158 2.600706


