%chk=000034039.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034039

1 1
 O   0.8524000      0.3231000      -1.955500    
 O  -0.2587000       1.437500       1.037200    
 N   -5.244700      0.4184000      6.8099998E-02
 C   -4.055100      0.3656000     -0.8145000    
 C   -2.780300      0.6107000     -1.4000000E-02
 C   -1.490400      0.5764000     -0.8375000    
 C   -6.523100      9.0400003E-02 -0.7166000    
 C   -5.118600     -0.5934000       1.216400    
 C   -5.409000       1.816300      0.6820000    
 C    1.093400      0.1730000     -0.5431000    
 C  -0.2228000      0.7686000      2.0999999E-03
 C    2.348300      0.9511000     -0.1242000    
 C    1.255700      -1.312300     -0.2212000    
 C    2.719900      0.9302000       1.198200    
 C    2.291800      -2.005600     -0.8058000    
 C    3.046200       1.635600      -1.089300    
 C   0.3599000      -1.903100      0.6413000    
 C    3.860100       1.637800       1.579000    
 C    2.439700      -3.361200     -0.5123000    
 C    4.186300       2.343100     -0.7086000    
 C   0.5078000      -3.258600      0.9348000    
 C    4.593300       2.344100      0.6257000    
 C    1.547800      -3.987700      0.3579000    
 H   -4.175200       1.120100      -1.601100    
 H   -4.025300     -0.6230000      -1.288600    
 H   -2.813200       1.586300      0.4810000    
 H   -2.659500     -0.1386000      0.7749000    
 H   -1.447300     -0.3985000      -1.335000    
 H   -1.513200       1.358000      -1.604700    
 H   -6.422000     -0.9199000      -1.123900    
 H   -7.378700      0.1471000     -3.7300002E-02
 H   -6.622900      0.8227000      -1.523100    
 H   -4.843700      -1.564200      0.7939000    
 H   -4.378600     -0.2450000       1.941000    
 H   -6.090700     -0.6624000       1.715500    
 H   -5.376500       2.553500     -0.1253000    
 H   -6.379300       1.852800       1.187600    
 H   -4.620800       1.996100       1.416400    
 H   0.4835000     -0.5029000      -2.311800    
 H    2.159100      0.3870000       1.952000    
 H    2.988700      -1.533300      -1.491100    
 H    2.760100       1.656300      -2.135000    
 H  -0.4521000      -1.375000       1.126500    
 H    4.176800       1.639000       2.617900    
 H    3.248500      -3.929300     -0.9626000    
 H    4.757900       2.893100      -1.450600    
 H  -0.1842000      -3.746200       1.615300    
 H    5.481100       2.895000      0.9221000    
 H    1.663200      -5.043100      0.5869000    


%chk=000034039-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000034039

1 1
O 0.546789 -1.082254 -1.955464
O -0.576866 -0.921844 1.425626
N -5.198981 1.245288 0.165030
C -3.936250 0.763658 -0.613515
C -2.762164 0.307979 0.258688
C -1.590646 -0.136998 -0.644350
C -6.257933 1.652220 -0.859827
C -5.756688 0.121413 1.036165
C -4.864812 2.451636 1.039570
C 0.921587 -0.870207 -0.530863
C -0.436941 -0.690586 0.198945
C 1.627417 0.498296 -0.348410
C 1.742812 -2.068328 -0.040885
C 2.083588 0.890879 0.937202
C 3.159949 -2.025784 -0.087150
C 1.792466 1.375838 -1.445956
C 1.103696 -3.280415 0.328452
C 2.716140 2.139620 1.113466
C 3.922858 -3.170374 0.233787
C 2.432836 2.624412 -1.267279
C 1.865727 -4.421620 0.654035
C 2.896168 3.009795 0.011193
C 3.278668 -4.371314 0.606468
H -3.645305 1.613550 -1.257368
H -4.285710 -0.059251 -1.263318
H -2.401418 1.119385 0.916395
H -3.034100 -0.539842 0.911692
H -1.887862 -0.930895 -1.357991
H -1.205130 0.688691 -1.270934
H -6.508083 0.781572 -1.485071
H -7.158281 2.003246 -0.332524
H -5.857046 2.459951 -1.491022
H -5.944737 -0.760984 0.405616
H -5.030851 -0.129522 1.821658
H -6.697626 0.461659 1.495415
H -4.427227 3.241249 0.409726
H -5.790641 2.816889 1.509978
H -4.147053 2.154196 1.815997
H 1.294923 -1.557412 -2.398924
H 1.946762 0.216921 1.790610
H 3.669465 -1.096459 -0.363751
H 1.431902 1.068997 -2.432878
H 0.010862 -3.333658 0.373194
H 3.075407 2.430961 2.106343
H 5.016252 -3.123079 0.195301
H 2.574703 3.290365 -2.125572
H 1.361482 -5.349168 0.945429
H 3.395848 3.974868 0.148283
H 3.869645 -5.257941 0.859788


