%chk=000033536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033536

0 1
 O    3.538600     -0.9217000      0.3654000    
 O    3.096300       2.586900      0.6981000    
 O    3.741000     -0.6028000      -1.922600    
 N    2.766800      0.2835000      0.4100000    
 C   -1.449000      0.3509000     -3.5200000E-02
 C   -2.882700      0.3267000     -0.1656000    
 C  -0.7861000     -0.7696000      0.5302000    
 C   -3.598700     -0.8173000      0.2743000    
 C   0.6122000     -0.7769000      0.6713000    
 C  -0.6319000       1.436400     -0.4392000    
 C    1.380000      0.3089000      0.2622000    
 C   -1.525500      -1.877500      0.9518000    
 C   -2.910600      -1.901100      0.8257000    
 C   0.7579000       1.416100     -0.2934000    
 C   -3.649800       1.385400     -0.7134000    
 C   -4.998400     -0.8723000      0.1610000    
 C   -5.041600       1.317800     -0.8203000    
 C   -5.716000      0.1885000     -0.3829000    
 C    3.542600       1.441700      0.6172000    
 C    5.036500       1.240300      0.7578000    
 C    3.961200      -1.237400     -0.8999000    
 C    4.757100      -2.506300     -0.8526000    
 H    1.101900      -1.644700       1.112000    
 H   -1.063600       2.324800     -0.8932000    
 H   -1.030100      -2.743500       1.387000    
 H   -3.447200      -2.784500       1.167100    
 H    1.304200       2.267100     -0.6861000    
 H   -3.175800       2.295300      -1.072300    
 H   -5.546700      -1.750000      0.4986000    
 H   -5.593200       2.150900      -1.246200    
 H   -6.797200      0.1313000     -0.4638000    
 H    5.494600       2.169100       1.112100    
 H    5.474800      0.9895000     -0.2110000    
 H    5.257700      0.4588000       1.489400    
 H    5.090500      -2.762800      -1.862200    
 H    5.637300      -2.367900     -0.2197000    
 H    4.134100      -3.320700     -0.4744000    


%chk=000033536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033536

0 1
O 3.484170 -0.761831 0.495717
O 3.286320 2.839293 0.404978
O 3.756012 -0.755508 -1.858216
N 2.863220 0.553790 0.370040
C -1.424677 0.417257 -0.015633
C -2.880281 0.326553 -0.144132
C -0.676078 -0.742026 0.400189
C -3.533883 -0.926040 0.151839
C 0.741031 -0.671669 0.530948
C -0.687740 1.610197 -0.282122
C 1.434015 0.518240 0.250412
C -1.372187 -1.977307 0.689872
C -2.745124 -2.064193 0.570059
C 0.702941 1.679129 -0.159275
C -3.694363 1.428330 -0.551959
C -4.953880 -1.031323 0.030400
C -5.086124 1.304119 -0.664686
C -5.725510 0.065105 -0.371947
C 3.736722 1.659378 0.438726
C 5.217906 1.337572 0.556657
C 3.854652 -1.355438 -0.782941
C 4.340786 -2.758478 -0.516653
H 1.284619 -1.559285 0.866339
H -1.211068 2.516967 -0.599568
H -0.784684 -2.846287 1.009315
H -3.264939 -3.003886 0.791602
H 1.236976 2.607783 -0.358257
H -3.233228 2.393304 -0.783445
H -5.432876 -1.990966 0.259299
H -5.686053 2.165058 -0.979512
H -6.813446 -0.024822 -0.461887
H 5.748856 2.286639 0.720017
H 5.594931 0.876755 -0.374296
H 5.423558 0.644905 1.389942
H 5.125978 -3.020742 -1.242476
H 4.715054 -2.865146 0.512695
H 3.499594 -3.462528 -0.654840


