%chk=000081103.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081103

0 1
 O   -1.135000      -1.673200      1.1900000E-02
 N  -0.2686000      0.4962000      2.4000001E-03
 C   -2.703100      0.1736000      7.1000000E-03
 C   -2.879200       1.040800      -1.253700    
 C   -2.886900       1.070100       1.241700    
 C   -3.771700     -0.9307000     -1.1000000E-02
 C   -1.286600     -0.4528000      7.1000000E-03
 C    1.129100      0.2679000      1.0000000E-03
 C    1.991300       1.351100     -3.0000000E-03
 C    1.602200      -1.033200      3.1000001E-03
 C    3.367900       1.126400     -4.9000001E-03
 C    2.978900      -1.257900      1.1000000E-03
 C    3.861800     -0.1781000     -2.7999999E-03
 H   -2.214000       1.910600      -1.260300    
 H   -3.905300       1.417900      -1.332900    
 H   -2.663900      0.4611000      -2.158900    
 H   -2.219100       1.937700       1.235200    
 H   -2.682600      0.5094000       2.161200    
 H   -3.913100       1.450200       1.302700    
 H   -3.666800      -1.572300     -0.8935000    
 H   -4.782400     -0.5078000     -2.2600001E-02
 H   -3.689600      -1.572400      0.8738000    
 H  -0.5323000       1.477600     -3.0000001E-04
 H    1.617300       2.371000     -4.8000002E-03
 H   0.9894000      -1.921800      5.7999999E-03
 H    4.055500       1.967200     -8.0000004E-03
 H    3.364800      -2.273200      2.6000000E-03
 H    4.933700     -0.3530000     -4.3000001E-03


%chk=000081103-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081103

0 1
O -1.165974 -1.713606 -0.001203
N -0.268432 0.447462 -0.002002
C -2.743778 0.206627 -0.006629
C -2.918118 1.072833 -1.289197
C -2.919821 1.090718 1.263104
C -3.808315 -0.915792 0.000797
C -1.332242 -0.457833 -0.002614
C 1.133219 0.191197 -0.000317
C 1.999997 1.318935 -0.001069
C 1.686308 -1.118146 0.002011
C 3.397971 1.144426 0.000426
C 3.089511 -1.274730 0.003493
C 3.953997 -0.156474 0.002714
H -2.224086 1.934230 -1.324632
H -3.946638 1.476751 -1.326335
H -2.754919 0.468476 -2.199508
H -2.226526 1.953155 1.287435
H -2.757853 0.499568 2.182258
H -3.948506 1.494893 1.292922
H -3.701300 -1.568567 -0.881816
H -4.820181 -0.470181 -0.003859
H -3.703523 -1.554502 0.893981
H -0.524307 1.437456 -0.002979
H 1.577901 2.332841 -0.002877
H 1.016911 -1.979583 0.002648
H 4.051930 2.023537 -0.000238
H 3.508024 -2.287577 0.005315
H 5.040452 -0.293712 0.003870


