%chk=000055486.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055486

0 1
 O    1.832600       1.271300      1.6799999E-02
 O    4.108600      -1.374700     -3.0999999E-02
 O    4.395000      0.8058000      2.4000001E-03
 N    3.631300     -0.2031000     -1.0200000E-02
 C   -1.394000     -0.2951000      6.3000000E-03
 C   -1.959400      -1.695000     -4.0800001E-02
 C   -3.426900      -1.776900      0.3686000    
 C   -2.251100      0.8360000     -2.4999999E-03
 C   -4.235500     -0.7143000     -0.3613000    
 C   -3.755000      0.6802000      3.0800000E-02
 C   2.2000000E-03 -5.7000000E-02  4.6000001E-03
 C   0.4702000       1.252100      1.7899999E-02
 C   -1.722400       2.139100      2.1600001E-02
 C    1.168100     -0.8743000     -1.0900000E-02
 C  -0.3472000       2.376300      2.9500000E-02
 C    2.246200     -2.1199999E-02 -1.5000000E-03
 C    1.237300      -2.349100     -4.0399998E-02
 H   -1.847000      -2.074400      -1.063800    
 H   -1.395000      -2.350700      0.6300000    
 H   -3.818100      -2.774300      0.1388000    
 H   -3.523600      -1.634500       1.452400    
 H   -5.299900     -0.8175000     -0.1225000    
 H   -4.133900     -0.8540000      -1.445000    
 H   -4.094300      0.9053000       1.049800    
 H   -4.219600       1.411900     -0.6412000    
 H   -2.395900       2.994200      3.5700001E-02
 H   5.7300001E-02   3.381200      4.3900002E-02
 H    2.185300      -2.729700     -0.4261000    
 H    1.091900      -2.758000      0.9646000    
 H   0.4704000      -2.766500     -0.6993000    


%chk=000055486-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055486

0 1
O 1.881583 1.349550 0.011629
O 4.111799 -1.456268 0.009935
O 4.477109 0.805959 -0.088033
N 3.695934 -0.221676 -0.031771
C -1.406770 -0.288718 0.013273
C -1.961415 -1.710741 0.000213
C -3.458080 -1.792018 0.372803
C -2.267690 0.838925 0.024625
C -4.263961 -0.718502 -0.386370
C -3.788376 0.685832 0.038852
C 0.005396 -0.038303 0.001308
C 0.475325 1.308804 0.019774
C -1.734387 2.167112 0.036580
C 1.194097 -0.889915 -0.025019
C -0.354132 2.435788 0.039498
C 2.274822 -0.003304 -0.012462
C 1.256124 -2.392588 -0.067130
H -1.820754 -2.138931 -1.014925
H -1.372982 -2.349518 0.683590
H -3.838404 -2.805293 0.146013
H -3.581984 -1.635237 1.463023
H -5.346073 -0.825797 -0.185803
H -4.118857 -0.853323 -1.477008
H -4.159450 0.895603 1.064039
H -4.239425 1.458535 -0.612952
H -2.438419 3.007993 0.043241
H 0.051130 3.450024 0.049619
H 2.268729 -2.733165 -0.324151
H 1.002871 -2.822337 0.921328
H 0.533840 -2.795393 -0.796519


