%chk=000106589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106589

0 1
 O   -1.801300       1.339000       1.254400    
 O    2.530600     -0.6562000     -4.8500001E-02
 O    2.769800       1.611400      0.3597000    
 N   -1.698200      0.1630000     -0.7456000    
 N    1.225100     -0.4409000      0.4086000    
 C   -1.947700      -1.152500     -0.1830000    
 C  -0.8994000      -1.487100      0.9018000    
 C   -1.940500      -2.195400      -1.310100    
 C   -3.339700      -1.138200      0.4688000    
 C   0.5337000      -1.540400      0.3910000    
 C   -1.648200       1.298400      3.7900001E-02
 C    1.081300      -2.873300     -6.2899999E-02
 C   -1.383400       2.514400     -0.7765000    
 C   -1.297500       3.713800     -0.1930000    
 C    3.206800      0.5287000     -7.8999996E-03
 C    4.608600      0.3153000     -0.4948000    
 H   -1.129200      -2.467500       1.340100    
 H  -0.9265000     -0.7869000       1.743100    
 H   -2.746300      -2.000200      -2.028000    
 H   -1.004700      -2.172900      -1.878600    
 H   -2.082100      -3.208600     -0.9187000    
 H   -3.397100     -0.4888000       1.347500    
 H   -4.105000     -0.7983000     -0.2393000    
 H   -3.622100      -2.144100      0.8017000    
 H   -1.561900      0.2369000      -1.750100    
 H   0.3120000      -3.648000     -2.0500001E-02
 H    1.906900      -3.168100      0.5908000    
 H    1.441400      -2.793400      -1.092200    
 H   -1.258800       2.419300      -1.849600    
 H   -1.103200       4.596300     -0.7936000    
 H   -1.414500       3.853100      0.8758000    
 H    5.153100       1.263300     -0.4593000    
 H    4.592200     -3.8100000E-02  -1.528800    
 H    5.120000     -0.4036000      0.1503000    


%chk=000106589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106589

0 1
O -2.396035 1.338606 1.292550
O 2.470719 -0.590450 0.229544
O 1.752974 0.577881 -1.674918
N -1.418737 0.304733 -0.576097
N 1.006956 -0.477045 0.649116
C -1.826055 -1.088877 -0.262578
C -1.050801 -1.578184 1.034803
C -1.467822 -1.949297 -1.499086
C -3.348712 -1.183776 0.007324
C 0.448475 -1.661716 0.786882
C -1.658815 1.395074 0.253471
C 1.106596 -3.013685 0.645766
C -0.979727 2.654312 -0.196529
C -1.170287 3.826495 0.459398
C 2.679582 0.152823 -0.947888
C 4.162689 0.346265 -1.180423
H -1.433965 -2.570157 1.334318
H -1.287014 -0.854193 1.835085
H -2.064898 -1.621253 -2.368236
H -0.398979 -1.860577 -1.769741
H -1.696321 -3.012838 -1.308012
H -3.627019 -0.593026 0.893163
H -3.908217 -0.791628 -0.860438
H -3.636316 -2.240482 0.159211
H -0.622743 0.402561 -1.219626
H 0.572115 -3.621982 -0.106317
H 1.032661 -3.555327 1.607825
H 2.166728 -2.929489 0.365245
H -0.312387 2.590737 -1.066584
H -0.676414 4.752335 0.146151
H -1.833035 3.857815 1.332431
H 4.373266 0.339758 -2.261084
H 4.754053 -0.426638 -0.666061
H 4.461685 1.331624 -0.778164


