%chk=000056907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056907

0 1
 O   -1.388700       1.770900      3.0000001E-04
 O   -4.001000     -0.5436000     -1.2000001E-03
 O   -3.989800       1.655800      1.0000000E-03
 N   -3.369600      0.5528000     -1.9999999E-04
 C   -1.019700     -0.4454000      3.0000001E-04
 C   -1.302700      -1.894900     -9.9999997E-05
 C   0.2464000      0.2071000      1.9999999E-04
 C    1.610100     -0.1940000     -9.9999997E-05
 C  -4.1299999E-02   1.568600      9.9999997E-05
 C   -1.972500      0.5458000      5.0000002E-04
 C    2.617800      0.8069000     -3.0000001E-04
 C   -2.059400      -2.372400      -1.260300    
 C   -2.058800      -2.374000       1.260100    
 C   0.9212000       2.574700     -9.9999997E-05
 C    2.258300       2.165100     -3.0000001E-04
 C    1.968200      -1.556800      9.9999997E-05
 C    3.962900      0.4063000     -1.9999999E-04
 C    3.312700      -1.925300      1.9999999E-04
 C    4.305800     -0.9478000       0.000000    
 H  -0.4146000      -2.498800     -1.1000000E-03
 H   -1.530500      -2.046100      -2.163700    
 H   -2.085600      -3.468700      -1.281000    
 H   -3.090300      -2.040100      -1.351300    
 H   -3.082900      -2.024400       1.363200    
 H   -2.102100      -3.469800       1.270700    
 H   -1.518100      -2.064500       2.162500    
 H   0.6509000       3.624200     -1.9999999E-04
 H    3.030300       2.933400     -3.9999999E-04
 H    1.298500      -2.390800      6.9999998E-04
 H    4.760100       1.146900     -1.9999999E-04
 H    3.589100      -2.976000      5.0000002E-04
 H    5.352300      -1.239800      1.9999999E-04


%chk=000056907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056907

0 1
O -1.398767 1.843714 0.001128
O -4.122609 -0.463096 0.001870
O -4.008525 1.823573 0.000634
N -3.455171 0.654411 0.002401
C -1.089761 -0.476894 0.000212
C -1.370735 -1.974328 -0.000784
C 0.220548 0.178047 0.000313
C 1.612229 -0.256128 0.000105
C -0.029565 1.577613 0.000616
C -2.019253 0.579551 0.001169
C 2.627618 0.787686 -0.000182
C -2.102299 -2.439968 -1.291147
C -2.101087 -2.441523 1.289722
C 0.941921 2.602497 0.000446
C 2.268982 2.186074 -0.000048
C 2.063867 -1.613521 0.000308
C 4.013199 0.428981 -0.000495
C 3.428132 -1.933629 0.000033
C 4.416187 -0.908721 -0.000429
H -0.393130 -2.478973 -0.001702
H -1.543874 -2.139853 -2.196395
H -2.182323 -3.542408 -1.286927
H -3.119651 -2.021847 -1.344022
H -3.118357 -2.023331 1.344126
H -2.181437 -3.543945 1.284174
H -1.541690 -2.142658 2.194772
H 0.646295 3.654031 0.000662
H 3.075266 2.927770 -0.000268
H 1.345495 -2.434020 0.000804
H 4.760719 1.230894 -0.000748
H 3.735357 -2.984961 0.000213
H 5.479418 -1.169736 -0.000660


