%chk=000008580.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008580

0 1
 O   -3.191000      0.6074000      0.1670000    
 O   -1.893900      -2.220500     -0.7223000    
 N   -1.626100      -1.658800      0.3463000    
 C   0.3819000     -0.3133000      0.1049000    
 C   0.9603000      0.9674000     -6.3000001E-02
 C   -1.015500     -0.4309000      0.1815000    
 C   0.1244000       2.092700     -0.1496000    
 C    1.218000      -1.438400      0.1911000    
 C    2.357600       1.085200     -0.1398000    
 C   -1.831000      0.6979000      9.4099998E-02
 C   -1.262100       1.957300     -7.1400002E-02
 C    2.604300      -1.302800      0.1132000    
 C    3.173100     -4.3299999E-02 -5.1899999E-02
 H   0.5473000       3.086800     -0.2789000    
 H   0.8228000      -2.443100      0.3218000    
 H    2.823900       2.059800     -0.2688000    
 H   -1.891200       2.840700     -0.1404000    
 H    3.240100      -2.180800      0.1817000    
 H    4.252400      6.1500002E-02 -0.1124000    
 H   -3.479600     -0.3121000      0.2786000    


%chk=000008580-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008580

0 1
O -3.247098 0.694360 0.046158
O -1.463911 -2.733888 0.173178
N -1.951127 -1.531949 0.124692
C 0.357366 -0.342488 0.022889
C 0.960127 0.972480 -0.049212
C -1.092392 -0.416187 0.057436
C 0.121022 2.145311 -0.084648
C 1.209595 -1.489963 0.054664
C 2.382693 1.096699 -0.086565
C -1.880580 0.786597 0.016667
C -1.267937 2.070521 -0.053582
C 2.605224 -1.332927 0.014795
C 3.199189 -0.040628 -0.055472
H 0.606335 3.127313 -0.138114
H 0.754256 -2.480268 0.111118
H 2.826169 2.098071 -0.141571
H -1.904438 2.958422 -0.081497
H 3.247033 -2.220498 0.038089
H 4.289072 0.059817 -0.084289
H -3.434899 -0.308096 0.096962


