%chk=000000922.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000922

0 1
 O    2.052400      -1.835100      0.5046000    
 O   -2.287500       1.345700     -0.5400000    
 O    2.918800     -0.6537000      -1.226000    
 N    2.743300       1.634900      0.3001000    
 N   -2.956700     -0.7513000      0.2016000    
 C   0.4077000      0.9258000      0.1065000    
 C    1.811600      0.5414000      0.5868000    
 C  -0.6301000     -0.1673000      0.3693000    
 C   -2.030700      0.2519000     -4.4199999E-02
 C    2.332300     -0.6786000     -0.1512000    
 C   -4.361100     -0.6137000     -0.1076000    
 H   0.4219000       1.144100     -0.9703000    
 H   9.1600001E-02   1.850700      0.6072000    
 H    1.826900      0.3452000       1.664300    
 H  -0.6477000     -0.4182000       1.436500    
 H  -0.3835000      -1.075300     -0.1921000    
 H    2.440900       2.475400      0.7920000    
 H    2.710100       1.867900     -0.6922000    
 H   -2.651300      -1.614000      0.6426000    
 H   -4.730300      -1.576800     -0.4681000    
 H   -4.521300      0.1557000     -0.8668000    
 H   -4.888000     -0.3410000      0.8101000    
 H    2.379400      -2.620500      1.6300000E-02


%chk=000000922-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000922

0 1
O 2.153832 -1.735799 0.797678
O -2.453343 1.406013 0.509480
O 3.086125 -0.768303 -1.094034
N 2.705830 1.747239 0.079975
N -2.996580 -0.798195 -0.009710
C 0.346985 0.795404 -0.035901
C 1.818587 0.649947 0.486708
C -0.642070 -0.260672 0.505868
C -2.096587 0.200247 0.331638
C 2.431979 -0.644817 -0.034868
C -4.433807 -0.543743 -0.167243
H 0.354769 0.794498 -1.143142
H -0.019316 1.788812 0.285855
H 1.780026 0.582992 1.590458
H -0.464110 -0.395878 1.592189
H -0.476279 -1.248654 0.037452
H 2.331962 2.681869 0.259310
H 3.105758 1.630360 -0.856070
H -2.643880 -1.745816 -0.149856
H -4.771854 -0.766738 -1.196220
H -4.600692 0.525684 0.038900
H -5.029055 -1.144348 0.545170
H 2.560419 -2.556904 0.405762


