%chk=000030019.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030019

0 1
 O  -6.5800004E-02 -0.7722000       2.084000    
 O    1.366900     -0.3547000      -2.368300    
 O    2.993000       2.434100      0.8929000    
 N    1.387800      0.8922000       1.468600    
 N    2.103100       1.101300     -0.7555000    
 C   0.1325000     -0.2815000     -0.2824000    
 C   -1.057000      0.6496000     -0.5777000    
 C   -2.296400      0.3079000      0.2700000    
 C  -0.2821000      -1.735300     -0.5522000    
 C   -1.410500      0.5790000      -2.065400    
 C   0.4742000     -0.1147000       1.194900    
 C    1.256200      0.1134000      -1.235400    
 C   -3.514100       1.177600     -5.1899999E-02
 C   0.7971000      -2.679200     -0.1376000    
 C    2.203800       1.549800      0.5559000    
 C   -4.728600      0.7529000      0.7600000    
 C   0.6399000      -3.620300      0.8000000    
 H  -0.7762000       1.689200     -0.3571000    
 H   -2.078500      0.4311000       1.335700    
 H   -2.617600     -0.7257000      0.1213000    
 H  -0.4771000      -1.921200      -1.614500    
 H   -1.189200      -2.026400     -1.7400000E-02
 H   -2.157300       1.338900      -2.319000    
 H   -1.830900     -0.3870000      -2.360200    
 H  -0.5820000      0.8246000      -2.731600    
 H   -3.799900       1.095100      -1.104000    
 H   -3.285800       2.230300      0.1494000    
 H    1.533100       1.119400       2.448400    
 H    2.775600       1.482500      -1.415100    
 H    1.757700      -2.614500     -0.6418000    
 H   -5.006100     -0.2834000      0.5421000    
 H   -4.531600      0.8379000       1.833500    
 H   -5.585700       1.390600      0.5214000    
 H    1.458800      -4.285700       1.051100    
 H  -0.2967000      -3.745800       1.331900    


%chk=000030019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030019

0 1
O -0.223896 -0.628080 2.177625
O 1.476949 -0.573303 -2.290152
O 2.913534 2.527119 0.849006
N 1.266690 0.982700 1.462562
N 2.064739 1.051043 -0.756460
C 0.076161 -0.387964 -0.265088
C -1.156032 0.575512 -0.689894
C -2.472068 0.177130 0.036903
C -0.286084 -1.896846 -0.423286
C -1.360894 0.626391 -2.223224
C 0.359919 -0.069958 1.214065
C 1.255155 -0.024151 -1.181026
C -3.489009 1.341692 0.119758
C 0.887632 -2.832450 -0.196180
C 2.128726 1.597529 0.538126
C -4.800347 0.920266 0.817214
C 1.016390 -3.648107 0.879919
H -0.877014 1.596400 -0.349873
H -2.259626 -0.169388 1.065613
H -2.939150 -0.675398 -0.496077
H -0.677658 -2.045940 -1.445986
H -1.087623 -2.127288 0.296863
H -2.263793 1.220868 -2.448671
H -1.506868 -0.382039 -2.648925
H -0.514025 1.092991 -2.753622
H -3.720719 1.724031 -0.894070
H -3.029907 2.185036 0.675340
H 1.369678 1.286275 2.436407
H 2.769735 1.393176 -1.417761
H 1.658187 -2.836586 -0.979995
H -5.299903 0.102496 0.264476
H -4.604669 0.559782 1.844312
H -5.509420 1.765341 0.883710
H 1.878700 -4.315554 0.991568
H 0.267111 -3.662925 1.680823


