%chk=000129105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129105

0 1
 O   -1.412700      -3.524900      0.8717000    
 O  -0.1811000     -0.6980000      -2.050200    
 O   -3.545100      -3.340000      0.1444000    
 N  -0.7248000      -1.102400      0.1679000    
 C   -2.119200      -1.395500     -5.0200000E-02
 C   -3.018100     -0.4350000      0.7411000    
 C   -2.787000       1.010200      0.4005000    
 C    1.552400     -0.5247000     -0.4806000    
 C   0.1396000     -0.7732000     -0.8669000    
 C   -2.440800      -2.836000      0.3209000    
 C    4.175600     -6.1200000E-02  0.2356000    
 C   -1.843500       1.740500       1.112100    
 C   -3.519700       1.599700     -0.6220000    
 C    5.593600      0.1915000      0.6232000    
 C    2.546200     -0.7472000      -1.411000    
 C    1.825600     -7.8100003E-02  0.7956000    
 C    3.872800     -0.5129000      -1.048800    
 C    3.152000      0.1563000       1.157900    
 C   -1.629200       3.082100      0.7961000    
 C   -3.305400       2.941300     -0.9381000    
 C   -2.360100       3.682500     -0.2291000    
 C    6.029000       1.624900      0.3300000    
 H   -2.332800      -1.303300      -1.122100    
 H   -2.863500     -0.5811000       1.819600    
 H   -4.074500     -0.6843000      0.5729000    
 H  -0.3744000      -1.239900       1.109900    
 H   -1.272000       1.286400       1.916600    
 H   -4.256600       1.030700      -1.182000    
 H    5.733400     -2.0099999E-02   1.690700    
 H    6.255900     -0.5053000      9.4499998E-02
 H    2.327700      -1.103100      -2.413400    
 H    1.057900      0.1348000       1.531700    
 H    4.661300     -0.6850000      -1.776700    
 H    3.374600      0.5171000       2.158700    
 H  -0.8938000       3.659300       1.348800    
 H   -3.874000       3.408700      -1.736800    
 H   -2.193100       4.727000     -0.4752000    
 H    5.943700       1.854200     -0.7375000    
 H    7.072200       1.771000      0.6272000    
 H    5.414200       2.345800      0.8795000    
 H   -1.666900      -4.445100       1.097300    


%chk=000129105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129105

0 1
O -1.615996 -3.395009 1.310954
O -0.299354 -0.719412 -2.013246
O -3.571422 -3.404014 0.055413
N -0.714644 -1.122042 0.240185
C -2.132309 -1.395396 0.018300
C -3.091252 -0.415130 0.771330
C -2.864616 1.063626 0.476874
C 1.577736 -0.583715 -0.472302
C 0.132186 -0.805137 -0.817130
C -2.529669 -2.818616 0.414052
C 4.364499 -0.187030 0.042427
C -3.078815 2.010548 1.511578
C -2.503775 1.537215 -0.810937
C 5.840848 0.065946 0.307606
C 2.528709 -0.695795 -1.518227
C 2.030762 -0.251860 0.831262
C 3.900073 -0.506048 -1.261175
C 3.405321 -0.057632 1.080268
C -2.948893 3.396377 1.269621
C -2.369839 2.922593 -1.054137
C -2.594179 3.858448 -0.018529
C 6.227681 1.555276 0.095072
H -2.295940 -1.307941 -1.071536
H -3.001746 -0.590109 1.861475
H -4.123749 -0.703885 0.489908
H -0.322285 -1.352254 1.153703
H -3.353431 1.659460 2.514762
H -2.301717 0.834163 -1.626809
H 6.093008 -0.226935 1.344670
H 6.456019 -0.564210 -0.362642
H 2.164008 -0.931862 -2.523238
H 1.317755 -0.102446 1.651106
H 4.623974 -0.608199 -2.078964
H 3.739899 0.204353 2.091566
H -3.121084 4.110985 2.082636
H -2.083039 3.268308 -2.053528
H -2.488988 4.932060 -0.210982
H 6.015923 1.873711 -0.941568
H 7.303788 1.713030 0.292032
H 5.652501 2.212759 0.771719
H -1.928550 -4.306479 1.560231


