%chk=000125406.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125406

0 1
 O    1.007600       2.775500      0.4545000    
 O   -1.227300      0.2923000     -0.3505000    
 O   0.8107000      -1.384900       1.889700    
 O   0.1940000      -2.921600      0.3407000    
 O   -4.780400      0.3162000      0.2058000    
 O   -3.436400      -1.263000     -0.7362000    
 N    2.702900      -2.693200     -0.7911000    
 N  -0.2783000       2.252000      0.3977000    
 C    1.750300     -0.4564000      -1.099600    
 C    1.190700      0.7860000     -0.4644000    
 C    2.154600      -1.533700     -8.2699999E-02
 C    1.880600       1.877700     -6.9700003E-02
 C  -0.1367000       1.047600     -0.1629000    
 C   0.9513000      -2.029400      0.7017000    
 C    3.294400       2.275900     -8.6199999E-02
 C   -2.493700      0.8280000      6.5399997E-02
 C   -3.584200     -0.1691000     -0.2122000    
 H    2.618000     -0.1810000      -1.714200    
 H   0.9993000     -0.8578000      -1.794500    
 H    2.911000      -1.157600      0.6158000    
 H    3.521100       2.962700      0.7355000    
 H    3.949600       1.405500      1.7100001E-02
 H    3.537600       2.777400      -1.027800    
 H    3.045300      -3.375200     -0.1152000    
 H    3.513700      -2.406100      -1.338200    
 H   -2.476600       1.019000       1.144700    
 H   -2.713700       1.739600     -0.5016000    
 H   3.7599999E-02  -1.715000       2.395100    
 H   -5.511200     -0.3158000      3.6600001E-02


%chk=000125406-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125406

0 1
O 0.807147 2.824261 0.501179
O -1.092794 0.184122 -0.938261
O 0.278798 -1.311997 1.408484
O 0.017949 -2.902372 -0.278916
O -4.319865 0.303446 0.812219
O -2.361200 -0.734272 1.462717
N 2.865561 -2.651698 -0.822228
N -0.492390 2.226183 0.172577
C 1.950473 -0.373097 -1.122057
C 1.268202 0.835605 -0.539827
C 2.109498 -1.591264 -0.139662
C 1.826088 1.954768 0.058130
C -0.150381 1.069148 -0.435650
C 0.705186 -2.034417 0.312185
C 3.227493 2.395153 0.324756
C -2.493510 0.519535 -0.696699
C -2.990247 -0.041595 0.633499
H 2.972743 -0.125041 -1.456768
H 1.393563 -0.728339 -2.009912
H 2.669756 -1.251615 0.748209
H 3.443235 2.403618 1.408723
H 3.939292 1.709376 -0.163204
H 3.403423 3.415820 -0.058777
H 2.283636 -3.140931 -1.515503
H 3.287758 -3.324798 -0.172554
H -2.662489 1.611351 -0.714267
H -3.063087 0.044856 -1.512552
H -0.727071 -1.319147 1.519563
H -4.664969 -0.071054 1.667896


