%chk=000028356.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028356

1 1
 O   -3.355500       1.004900     -0.7528000    
 N    1.240400      7.0699997E-02 -0.3780000    
 N    2.910200      -1.472200      0.2027000    
 N   -2.354400     -0.8054000      0.3167000    
 C  -7.8400001E-02  0.1115000      0.3517000    
 C    2.281600      0.7114000      0.3912000    
 C    1.155900      0.6496000      -1.767700    
 C    1.782700      -1.325400     -0.4167000    
 C   -1.088600     -0.7662000     -0.3637000    
 C    3.195100     -0.2227000      0.6859000    
 C    2.306500       2.148800      0.7709000    
 C   -3.386700      8.8000000E-02  6.3699998E-02
 C   -4.608800     -0.1929000      0.8961000    
 H   8.0399998E-02 -0.2396000       1.380200    
 H  -0.4189000       1.153700      0.3900000    
 H    2.167700      0.7474000      -2.177800    
 H   0.5825000     -2.7200000E-02  -2.407100    
 H   0.6725000       1.630100      -1.715900    
 H    1.285700      -2.149100     -0.9503000    
 H   -1.276800     -0.4162000      -1.383000    
 H  -0.7651000      -1.808500     -0.4197000    
 H    4.099700     -5.9000000E-02   1.254400    
 H    2.285400       2.785800     -0.1184000    
 H    3.212200       2.395500       1.334800    
 H    1.446200       2.400100       1.398300    
 H   -2.489700      -1.526300       1.019800    
 H   -5.297700      0.6541000      0.8361000    
 H   -5.106900      -1.090500      0.5199000    
 H   -4.329500     -0.3426000       1.943000    


%chk=000028356-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028356

1 1
O -2.278570 0.971795 -0.680297
N 1.212742 -0.055493 -0.371831
N 3.278381 -1.180547 -0.267068
N -2.345783 -1.009402 0.491648
C 0.059037 -0.436218 0.604498
C 2.228413 0.813792 0.366074
C 0.708203 0.638096 -1.657100
C 2.064599 -1.284807 -0.707224
C -1.017457 -1.371154 -0.017642
C 3.393868 0.101568 0.390766
C 1.847114 2.160264 0.880546
C -2.936410 0.180372 0.070719
C -4.349144 0.452979 0.541389
H 0.544301 -0.884459 1.488328
H -0.412169 0.518407 0.880490
H 1.549028 1.197071 -2.093262
H 0.362083 -0.124478 -2.368840
H -0.141623 1.286480 -1.392814
H 1.621403 -2.108185 -1.267781
H -1.027215 -1.266978 -1.117920
H -0.815395 -2.425931 0.229272
H 4.346828 0.394669 0.826723
H 1.420121 2.804042 0.089418
H 2.739991 2.666332 1.280737
H 1.103743 2.105590 1.698251
H -2.860990 -1.667154 1.078240
H -4.399548 1.455024 0.999236
H -5.023697 0.467929 -0.332855
H -4.724152 -0.291805 1.262597


