%chk=000033474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033474

0 1
 O    3.186600       3.016800      0.3335000    
 N   0.2738000      -1.612800     -0.2161000    
 N    2.821300      0.7558000      0.3788000    
 N    1.242100      -2.478400      0.1254000    
 N   0.2045000       2.007900     -0.7469000    
 C   0.6472000     -0.2927000     -0.1635000    
 C    1.985200     -0.3256000      0.1799000    
 C  -0.2165000      0.8558000     -0.3458000    
 C    2.282000      -1.685100      0.3873000    
 C   -1.009900      -2.152400     -0.6056000    
 C   -1.662800      0.7287000     -2.1500001E-02
 C    1.574800       2.160300      -1.210200    
 C    2.567300       2.033700     -7.6800004E-02
 C    3.558100      -2.282300      0.8192000    
 C   -1.040600      -3.669600     -0.5363000    
 C   -2.110100       1.018100       1.263200    
 C   -2.555900      0.3228000      -1.007200    
 C   -3.466600      0.9003000       1.565600    
 C   -3.912500      0.2050000     -0.7046000    
 C   -4.367900      0.4938000      0.5817000    
 H   -1.753600      -1.805300      0.1106000    
 H   -1.211100      -1.838400      -1.631300    
 H    3.657200      0.5930000      0.9326000    
 H    1.683000       3.161900      -1.642000    
 H    1.816800       1.455800      -2.015200    
 H    4.367700      -1.990600      0.1424000    
 H    3.816300      -1.944500       1.828100    
 H    3.513500      -3.376500      0.8336000    
 H  -0.3123000      -4.123700      -1.217500    
 H   -2.031700      -4.032200     -0.8299000    
 H  -0.8453000      -4.038000      0.4771000    
 H   -1.415500       1.335400       2.036100    
 H   -2.221000      0.1299000      -2.022800    
 H   -3.821200       1.125500       2.567100    
 H   -4.615300     -0.1038000      -1.472900    
 H   -5.424400      0.4038000      0.8168000    


%chk=000033474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033474

0 1
O 3.257493 2.767570 -0.891071
N 0.239100 -1.839174 0.419582
N 2.632176 0.859354 0.281510
N 1.322847 -2.475293 1.014501
N 0.107973 1.407581 -1.392005
C 0.541984 -0.524195 0.051227
C 1.894041 -0.328339 0.438313
C -0.340394 0.499324 -0.537340
C 2.330345 -1.548701 1.046228
C -0.901130 -2.680573 0.003353
C -1.770067 0.613488 -0.110358
C 1.506354 1.311379 -1.875987
C 2.538296 1.736511 -0.811143
C 3.663763 -1.866197 1.659399
C -0.747218 -3.204218 -1.438871
C -2.190234 0.208533 1.185531
C -2.718906 1.195655 -0.992503
C -3.532518 0.380496 1.588047
C -4.060648 1.358790 -0.592075
C -4.473326 0.951206 0.699685
H -0.931627 -3.518110 0.719413
H -1.829292 -2.096737 0.108182
H 3.362068 1.085378 0.963658
H 1.627615 1.998603 -2.725686
H 1.758856 0.274066 -2.194384
H 4.492682 -1.631684 0.966154
H 3.837440 -1.297090 2.593023
H 3.711838 -2.938757 1.907310
H -0.725240 -2.372708 -2.165562
H -1.602339 -3.856161 -1.692600
H 0.181673 -3.790964 -1.543738
H -1.461396 -0.215200 1.886150
H -2.376633 1.525148 -1.978373
H -3.841847 0.076672 2.594201
H -4.784840 1.805413 -1.282333
H -5.515688 1.081332 1.011464


