%chk=000047027.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047027

1 1
 O    1.152600      0.1563000      0.2485000    
 N   -1.688500      0.2622000     -8.9999998E-04
 C  -0.9437000      -1.008400      0.3825000    
 C   0.4676000      -1.012400     -0.1956000    
 C   -1.733900      0.3858000      -1.517200    
 C   -3.107600      0.2029000      0.5460000    
 C  -0.9691000       1.468600      0.5849000    
 C    1.283100      -2.248000      0.1624000    
 C    2.430700      0.2692000     -0.3591000    
 C    3.108800       1.523900      0.1485000    
 H  -0.9211000      -1.047500       1.478500    
 H   -1.523900      -1.861600      1.1600000E-02
 H   0.4078000     -0.9996000      -1.289900    
 H   -2.109700     -0.5532000      -1.934400    
 H   -2.417100       1.204000      -1.767400    
 H  -0.7436000      0.6276000      -1.910600    
 H   -3.053500      0.1295000       1.636200    
 H   -3.638100       1.112800      0.2496000    
 H   -3.603100     -0.6775000      0.1259000    
 H  -0.5964000       1.232000       1.586000    
 H  -0.2042000       1.841000     -0.1004000    
 H   -1.706000       2.275100      0.6786000    
 H    1.658800      -2.194200       1.189800    
 H    2.141300      -2.384800     -0.5032000    
 H   0.6724000      -3.152400      6.5600000E-02
 H    3.082100     -0.5679000     -9.4599999E-02
 H    2.326600      0.3199000      -1.448600    
 H    4.099400       1.642900     -0.2995000    
 H    2.507500       2.408400     -8.6400002E-02
 H    3.214800       1.492000       1.238000    


%chk=000047027-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000047027

1 1
O 1.236430 0.137481 0.066789
N -1.690523 0.313518 0.076579
C -0.883953 -0.973045 0.404866
C 0.510324 -1.102224 -0.238141
C -1.533996 0.711441 -1.388800
C -3.165565 0.032067 0.364653
C -1.226435 1.473741 0.967847
C 1.186426 -2.371408 0.320633
C 2.620321 0.203984 -0.481215
C 3.122537 1.632515 -0.291186
H -0.795746 -0.999378 1.504713
H -1.504827 -1.824351 0.076084
H 0.414373 -1.205300 -1.343126
H -1.791223 -0.145693 -2.029893
H -2.217468 1.548911 -1.597747
H -0.493360 1.022757 -1.556113
H -3.263596 -0.355718 1.390209
H -3.734747 0.969136 0.266542
H -3.542309 -0.711469 -0.354447
H -1.476701 1.235125 2.013215
H -0.139366 1.573899 0.847406
H -1.755583 2.387239 0.654372
H 1.393637 -2.262586 1.399796
H 2.138715 -2.570695 -0.197138
H 0.546168 -3.260315 0.171992
H 3.260158 -0.515461 0.063824
H 2.597340 -0.080525 -1.554821
H 4.162495 1.714127 -0.653765
H 2.507644 2.355903 -0.854400
H 3.112829 1.912924 0.776074


