%chk=000033443.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033443

0 1
 O  -0.2716000       3.205300      0.3048000    
 N    1.459600      -1.084500     -0.2397000    
 N  -0.8632000     -0.7852000     -0.1187000    
 N   0.6260000       1.090100      3.4400001E-02
 N   -3.176700     -0.4236000      9.4999997E-03
 N   -1.746200       1.428300      0.1615000    
 C    2.835500     -0.6327000     -0.2428000    
 C    3.777100      -1.797400      8.5699998E-02
 C    3.152400     -4.5600001E-02  -1.614300    
 C    3.494400      -2.414600       1.449600    
 C   0.3761000     -0.2353000     -0.1039000    
 C   -1.864900      9.8600000E-02  1.7700000E-02
 C   -3.455000      -1.818200     -0.1351000    
 C  -0.4721000       1.852400      0.1609000    
 C   -4.948600      -2.089100     -7.3299997E-02
 C    1.077100       3.651200      0.3039000    
 H    2.984200      0.1406000      0.5221000    
 H    4.815100      -1.443800      6.6600002E-02
 H    3.692700      -2.581100     -0.6777000    
 H    4.196400      0.2821000      -1.662200    
 H    2.994200     -0.7834000      -2.409200    
 H    2.525600      0.8222000      -1.843300    
 H    1.256500      -2.063200     -0.4081000    
 H    2.503800      -2.877900       1.487800    
 H    4.232700      -3.192800       1.668400    
 H    3.554200      -1.660400       2.240700    
 H   -3.069800      -2.184000      -1.094200    
 H   -2.963400      -2.388400      0.6618000    
 H   -3.931400      0.2454000      0.1100000    
 H   -5.367700      -1.759200      0.8832000    
 H   -5.477000      -1.556700     -0.8714000    
 H   -5.148300      -3.159400     -0.1845000    
 H    1.567300       3.421500     -0.6482000    
 H    1.634900       3.221100       1.142600    
 H    1.072900       4.738500      0.4257000    


%chk=000033443-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000033443

0 1
O -0.317414 3.174622 0.519049
N 1.456905 -1.103545 -0.359831
N -0.854208 -0.838122 -0.184681
N 0.650773 1.073110 0.069703
N -3.164773 -0.445360 0.027897
N -1.754348 1.395261 0.279435
C 2.871880 -0.682850 -0.422145
C 3.774050 -1.825763 0.105099
C 3.259921 -0.250159 -1.856852
C 3.549747 -2.157057 1.595584
C 0.395130 -0.263123 -0.154652
C -1.885124 0.038646 0.038847
C -3.508514 -1.855371 -0.207544
C -0.469687 1.823200 0.279788
C -5.030769 -2.053782 -0.117202
C 1.062914 3.698400 0.533929
H 2.963096 0.194865 0.243791
H 4.827967 -1.529151 -0.058639
H 3.610379 -2.732013 -0.516605
H 4.299178 0.127100 -1.881579
H 3.184605 -1.099776 -2.561421
H 2.590208 0.554364 -2.206369
H 1.211026 -2.074736 -0.563547
H 2.498062 -2.434359 1.790662
H 4.190886 -2.997274 1.918754
H 3.786043 -1.284747 2.232808
H -3.133207 -2.167141 -1.201578
H -2.987276 -2.489265 0.535264
H -3.899367 0.243706 0.196294
H -5.412131 -1.777158 0.883112
H -5.560169 -1.445116 -0.873610
H -5.287413 -3.112141 -0.296058
H 1.556276 3.531827 -0.438807
H 1.658177 3.211237 1.324951
H 0.939979 4.772472 0.736452


