%chk=000072699.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072699

0 1
 O   -1.506900      -2.493800      0.1471000    
 O   -3.294300     -0.6892000     -0.6127000    
 N   -2.913800       1.389900      0.3441000    
 N   -4.253000       1.729000      0.3225000    
 C    1.217700      0.6569000     -7.8900002E-02
 C    1.676400     -0.6739000      6.7900002E-02
 C   -1.078500     -0.1463000     -7.1599998E-02
 C  -0.1632000      0.9038000     -0.1471000    
 C   0.7408000      -1.718500      0.1423000    
 C  -0.6274000      -1.455000      7.2800003E-02
 C    2.153400       1.701600     -0.1533000    
 C    3.057300     -0.9208000      0.1362000    
 C    3.521700       1.438000     -8.3800003E-02
 C    3.972700      0.1294000      6.0699999E-02
 C   -2.502800      0.1488000     -0.1462000    
 H  -0.4954000       1.929800     -0.2909000    
 H    1.077900      -2.747500      0.2551000    
 H    1.824200       2.732400     -0.2661000    
 H    3.432600      -1.935800      0.2492000    
 H    4.234900       2.255000     -0.1425000    
 H    5.038100     -7.5099997E-02  0.1149000    
 H   -2.280200       2.051800      0.7801000    
 H   -2.420100      -2.169500      0.1902000    
 H   -4.525100       1.919300       1.286000    
 H   -4.324200       2.618000     -0.1708000    


%chk=000072699-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072699

0 1
O -1.568474 -2.405242 0.117260
O -3.399112 -0.646269 0.186630
N -2.964969 1.615921 0.185930
N -4.343259 1.956598 0.234424
C 1.312844 0.710093 0.040256
C 1.714195 -0.686958 0.021264
C -1.064676 0.019531 0.113066
C -0.075874 1.020288 0.085834
C 0.714782 -1.699601 0.047964
C -0.649016 -1.377421 0.092900
C 2.321321 1.733224 0.013662
C 3.117518 -0.996920 -0.023955
C 3.674036 1.398743 -0.029736
C 4.072120 0.019696 -0.048681
C -2.523882 0.307104 0.163079
H -0.348757 2.083362 0.099568
H 0.992910 -2.757985 0.033914
H 2.011274 2.785463 0.028481
H 3.426332 -2.048449 -0.038580
H 4.438282 2.182784 -0.049524
H 5.138243 -0.230837 -0.083017
H -2.325806 2.408724 0.167861
H -2.504846 -1.978102 0.149751
H -4.772409 1.578599 1.091878
H -4.829978 1.585953 -0.595028


