%chk=000126788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126788

0 1
 O    4.185600      0.1841000       1.815000    
 O  -0.7587000       2.594100      0.2932000    
 O   -2.197400      -2.741600      9.3900003E-02
 N    3.583600     -2.4000001E-03  0.5881000    
 C    4.440200      0.2194000     -0.5488000    
 C    2.224500     -0.3622000      0.4764000    
 C  -0.1150000      0.2862000      0.3055000    
 C  -0.4826000      -1.076300      0.2544000    
 C    3.628700     -1.9999999E-04  -1.828600    
 C    4.961200       1.657300     -0.4909000    
 C    5.606100     -0.7713000     -0.4890000    
 C    1.243200      0.6275000      0.4166000    
 C   -1.115100       1.271000      0.2441000    
 C   -2.473100      0.9288000      0.1331000    
 C   -1.840600      -1.418500      0.1434000    
 C   -2.840700     -0.4337000      8.2000002E-02
 C    1.862300      -1.704500      0.4261000    
 C   0.5181000      -2.060500      0.3158000    
 C   -3.473800       1.912900      7.1699999E-02
 C   -4.198900     -0.7751000     -2.8899999E-02
 C   -4.818000       1.556900     -3.8400002E-02
 C   -5.180100      0.2146000     -8.8699996E-02
 C  -0.4941000       3.231400     -0.9505000    
 C   -2.265600      -3.337500      -1.195700    
 H    2.791900      0.7001000      -1.928700    
 H    4.266900      0.1661000      -2.706100    
 H    3.248500      -1.023500      -1.922900    
 H    5.579700       1.836000      0.3961000    
 H    4.136500       2.379100     -0.4649000    
 H    5.576700       1.886600      -1.368200    
 H    6.222100     -0.6255000      0.4057000    
 H    5.247300      -1.807000     -0.4718000    
 H    6.261800     -0.6594000      -1.360000    
 H    1.555600       1.668800      0.4683000    
 H    2.617900      -2.484600      0.4744000    
 H   0.2762000      -3.120300      0.2885000    
 H   -3.233400       2.972400      0.1171000    
 H   -4.524100      -1.812300     -6.1999999E-02
 H    3.859500       1.063900       2.071200    
 H   -5.581800       2.327700     -8.2300000E-02
 H   -6.226800     -6.3100003E-02 -0.1719000    
 H   0.3458000       2.754900      -1.466000    
 H  -0.2296000       4.273500     -0.7507000    
 H   -1.377400       3.216900      -1.596600    
 H   -2.558800      -4.384000      -1.073300    
 H   -1.292400      -3.307900      -1.695300    
 H   -3.014200      -2.840200      -1.820300    


%chk=000126788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126788

0 1
O 4.351753 -0.580420 1.655292
O -0.869665 2.687095 -0.190285
O -2.148356 -2.808148 0.491179
N 3.604848 0.366865 0.747343
C 4.438804 0.478221 -0.532646
C 2.239323 -0.121009 0.631218
C -0.143200 0.387779 0.256222
C -0.475022 -1.020404 0.432575
C 3.717688 1.451691 -1.495572
C 5.804230 1.079827 -0.126727
C 4.630816 -0.905175 -1.208628
C 1.224241 0.805619 0.388771
C -1.187945 1.313174 -0.019298
C -2.549240 0.907689 -0.073602
C -1.828457 -1.434926 0.320890
C -2.878984 -0.501924 0.099627
C 1.908185 -1.514692 0.822348
C 0.590368 -1.941889 0.731901
C -3.617264 1.848093 -0.295169
C -4.259727 -0.905044 0.044867
C -4.940105 1.420538 -0.354522
C -5.265087 0.030052 -0.182689
C -0.563444 3.062993 -1.586089
C -2.129815 -3.589962 -0.762930
H 3.546316 2.430468 -1.013049
H 4.356662 1.608280 -2.383158
H 2.748769 1.049407 -1.836976
H 6.357583 0.387485 0.528421
H 5.659696 2.035986 0.407489
H 6.413688 1.270174 -1.028506
H 5.091989 -1.615530 -0.501525
H 3.665126 -1.320575 -1.548814
H 5.292684 -0.807374 -2.088225
H 1.453832 1.872630 0.336181
H 2.712728 -2.210452 1.071572
H 0.329417 -2.989472 0.911804
H -3.360489 2.907947 -0.385432
H -4.496337 -1.959547 0.216921
H 4.427233 -0.043070 2.486295
H -5.745607 2.145642 -0.515008
H -6.313604 -0.286039 -0.213991
H 0.322317 2.511960 -1.958686
H -0.352180 4.143338 -1.565777
H -1.427548 2.858332 -2.247672
H -2.391876 -4.620210 -0.476546
H -1.123958 -3.570248 -1.225555
H -2.872687 -3.196578 -1.483740


