%chk=000037790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037790

0 1
 O    1.827600       4.064900     -9.2200004E-02
 O  -0.5514000       3.788700     -0.3313000    
 O   -1.205700      -2.784400      -1.435700    
 O    5.579200      -1.816400       1.140600    
 O    3.569600      -1.353200       2.089900    
 N   0.1222000      -1.127800     -0.6493000    
 C    1.776700      0.3960000     -0.3816000    
 C   0.3824000      0.2417000     -0.5144000    
 C    2.348800     -0.8975000     -0.4328000    
 C    1.327700      -1.800200     -0.5887000    
 C    2.338600       1.684700     -0.2304000    
 C  -0.4813000       1.358200     -0.5109000    
 C    3.788500      -1.219100     -0.3317000    
 C    1.468000       2.757900     -0.2252000    
 C   0.1139000       2.599000     -0.3608000    
 C   -1.140200      -1.746100     -0.7858000    
 C    1.454700      -3.274100     -0.6862000    
 C   -2.396900      -1.225500     -0.2138000    
 C   0.5416000       4.712200     -0.1580000    
 C    4.268100      -1.461500       1.091400    
 C   -2.367000     -0.4833000      0.9639000    
 C   -3.607000      -1.478500     -0.8550000    
 C   -4.769000     -0.2423000      0.8650000    
 C   -3.555000      8.9999996E-03   1.504400    
 C   -4.795000     -0.9861000     -0.3148000    
 C   -6.039300      0.2837000       1.443400    
 H    3.408200       1.830300     -0.1222000    
 H   -1.545400       1.288300     -0.6899000    
 H    4.384600     -0.3940000     -0.7398000    
 H    4.027700      -2.107800     -0.9265000    
 H   0.7175000      -3.778800     -5.2999999E-02
 H    1.319100      -3.604800      -1.720900    
 H    2.434800      -3.627800     -0.3523000    
 H   0.3831000       5.274200      0.7696000    
 H   0.5445000       5.414800     -0.9991000    
 H   -1.446900     -0.3174000       1.516900    
 H   -3.648000      -2.051000      -1.777900    
 H   -3.523400      0.5755000       2.431400    
 H   -5.734600      -1.189000     -0.8218000    
 H    5.881500      -1.970500       2.061100    
 H   -5.869100       1.221800       1.982600    
 H   -6.773600      0.4944000      0.6584000    
 H   -6.467100     -0.4471000       2.136900    


%chk=000037790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037790

0 1
O 2.017594 4.036467 0.057020
O -0.341543 3.884202 -0.308205
O -1.287036 -2.652545 -1.867541
O 4.849985 -0.255546 1.534064
O 4.110110 -2.422367 1.933773
N 0.078216 -1.148419 -0.701830
C 1.823488 0.307894 -0.330099
C 0.401521 0.229866 -0.503422
C 2.352224 -1.042550 -0.440562
C 1.291501 -1.911446 -0.680071
C 2.474290 1.560908 -0.130514
C -0.427097 1.381770 -0.552752
C 3.812687 -1.417379 -0.316174
C 1.646289 2.678987 -0.158888
C 0.244994 2.590399 -0.371534
C -1.202239 -1.697892 -1.043801
C 1.300583 -3.406388 -0.816819
C -2.404645 -1.148242 -0.348887
C 0.814312 4.817412 -0.317622
C 4.254045 -1.466963 1.142666
C -2.354339 -0.657021 0.983576
C -3.658231 -1.228509 -1.008249
C -4.792651 -0.300467 0.969831
C -3.535047 -0.245306 1.630052
C -4.831868 -0.797140 -0.360287
C -6.058517 0.139963 1.680486
H 3.549924 1.632462 0.043576
H -1.504861 1.349062 -0.711324
H 4.440274 -0.685012 -0.852296
H 3.993801 -2.414505 -0.749108
H 0.559804 -3.879858 -0.146965
H 1.046617 -3.726414 -1.841634
H 2.292822 -3.800400 -0.543799
H 0.646423 5.602572 0.434159
H 0.945173 5.216986 -1.342605
H -1.396515 -0.610714 1.511692
H -3.691916 -1.635738 -2.024205
H -3.485055 0.124652 2.661035
H -5.792169 -0.849318 -0.886269
H 5.084058 -0.299076 2.501290
H -5.917995 1.110502 2.189966
H -6.904677 0.239964 0.979827
H -6.351634 -0.593752 2.455950


