%chk=000029754.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029754

0 1
 I    1.531900       2.898400     -0.9812000    
 I    1.379500      -3.133800     -5.2999999E-02
 I   -3.812600      8.2000002E-02 -0.1022000    
 O   -1.947700      -2.685300       1.436500    
 O   -2.238500      -3.186500     -0.7613000    
 O    3.226000      0.1620000       1.616100    
 O   -1.721600       3.249900       1.565700    
 N    2.485800     -0.1569000     -0.5977000    
 N   -1.633200       2.393700     -0.6373000    
 C    1.088700     -0.1047000     -0.4878000    
 C  -0.9654000       1.167200     -0.5074000    
 C   -1.026400      -1.219700     -0.1399000    
 C   0.4242000       1.115100     -0.6168000    
 C   0.3633000      -1.272100     -0.2494000    
 C   -1.690700     -9.9999997E-05 -0.2689000    
 C   -1.787500      -2.444800      0.1099000    
 C    3.432000     -2.3800001E-02  0.4211000    
 C    4.838300     -0.1413000     -0.1109000    
 C   -1.946000       3.300600      0.3645000    
 H    2.831200     -0.1916000      -1.554400    
 H   -1.918700       2.630900      -1.584400    
 H    4.944900      -1.062300     -0.6911000    
 H    5.547700     -0.1656000      0.7209000    
 H    5.062400      0.7194000     -0.7470000    
 H   -2.475000       4.164300     -7.3700003E-02
 H   -2.457600      -3.507100       1.600500    


%chk=000029754-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029754

0 1
I 1.390488 2.972659 -1.255916
I 1.417555 -3.093815 -0.244632
I -3.858038 0.033813 0.059932
O -1.829296 -2.806307 1.492269
O -2.285943 -3.217058 -0.752906
O 3.010219 -0.644002 1.552305
O -1.094761 3.532180 1.268220
N 2.513866 -0.006604 -0.645279
N -1.800151 2.428815 -0.692370
C 1.098265 -0.016171 -0.515243
C -1.059977 1.216435 -0.540063
C -1.023071 -1.215923 -0.100813
C 0.351499 1.184882 -0.691185
C 0.384495 -1.220800 -0.260187
C -1.729921 0.001484 -0.228353
C -1.771798 -2.506711 0.135189
C 3.406652 -0.298198 0.410642
C 4.875645 -0.198383 0.019617
C -1.794066 3.481686 0.231142
H 2.904424 0.443147 -1.477697
H -2.501537 2.468005 -1.438218
H 5.217921 -1.180098 -0.357846
H 5.465754 0.047157 0.915221
H 5.065905 0.558084 -0.762519
H -2.498903 4.286797 -0.078796
H -2.320223 -3.663178 1.628286


