%chk=000056144.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056144

0 1
 O    1.890600       1.507100      -1.037100    
 O    2.263100       1.274400       1.183600    
 N   6.7100003E-02 -0.6501000     -0.5159000    
 N   -3.008800      0.8135000       1.075800    
 C   -2.278300      9.1499999E-02  2.1800000E-02
 C  -0.7984000      5.2999998E-03  0.4618000    
 C    1.449000     -0.6560000     -6.0600001E-02
 C   -2.439400      0.8638000      -1.296700    
 C   -2.906400      -1.303700     -0.1107000    
 C    1.531600      -1.411700       1.270000    
 C    2.336300      -1.326700      -1.111200    
 C    1.893500      0.7926000      0.1191000    
 H  -0.7908000     -0.5385000       1.413100    
 H  -0.4583000       1.027800      0.6674000    
 H   2.7999999E-03 -0.1762000      -1.415700    
 H   -1.954800       1.845700      -1.246100    
 H   -3.498200       1.028700      -1.530700    
 H   -2.008400      0.3181000      -2.142900    
 H   -2.810400      -1.877400      0.8187000    
 H   -3.974100      -1.238100     -0.3516000    
 H   -2.427900      -1.882500     -0.9084000    
 H    1.019700      -2.380200       1.218800    
 H    2.579900      -1.621600       1.518600    
 H    1.136600     -0.8531000       2.125400    
 H    2.249000     -0.8466000      -2.093100    
 H    3.393000      -1.275900     -0.8232000    
 H    2.073400      -2.383500      -1.237000    
 H   -2.611600       1.744200       1.199900    
 H   -2.898300      0.3341000       1.968700    
 H    2.199600       2.427700     -0.8983000    


%chk=000056144-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056144

0 1
O 2.093293 1.597571 -0.792892
O 2.622055 1.074680 1.402952
N 0.085798 -0.453727 -0.478265
N -3.194990 0.908068 0.959165
C -2.340793 0.123525 0.028120
C -0.834438 0.246151 0.448215
C 1.500602 -0.654332 -0.050701
C -2.554363 0.693702 -1.394545
C -2.791776 -1.351562 0.089827
C 1.586009 -1.584312 1.177003
C 2.262286 -1.277146 -1.247631
C 2.150815 0.710984 0.303411
H -0.727688 -0.199412 1.454693
H -0.601569 1.337291 0.546328
H 0.068049 -0.013028 -1.409076
H -2.171651 1.730716 -1.473764
H -3.633759 0.709094 -1.621935
H -2.048367 0.075386 -2.157930
H -2.757307 -1.729690 1.130560
H -3.828717 -1.450044 -0.275215
H -2.120176 -1.978758 -0.520278
H 1.047432 -2.520042 0.951311
H 2.639233 -1.816538 1.409526
H 1.150393 -1.124971 2.079348
H 2.218194 -0.619533 -2.133471
H 3.324042 -1.445824 -0.995981
H 1.797288 -2.246866 -1.496277
H -2.984893 1.913980 0.961921
H -3.218361 0.525470 1.912067
H 2.484459 2.471869 -0.522986


