%chk=000029536.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029536

0 1
 O   0.6910000      -2.886300      0.6696000    
 O    4.644700      0.4431000      -1.093900    
 O  -0.4241000       1.557300      0.6936000    
 N    2.348900       2.313200      0.6323000    
 C    1.405900     -0.8286000      7.1099997E-02
 C    2.382900      7.6099999E-02 -0.3801000    
 C    2.091900       1.531300     -0.5759000    
 C   3.8400002E-02 -0.7449000      0.4439000    
 C    1.759200      -2.165000      0.2269000    
 C    3.670100     -0.4061000     -0.6545000    
 C  -0.8247000      0.3996000      0.4698000    
 C  -0.3457000      -2.017600      0.7974000    
 C    3.029400      -2.673700     -3.7799999E-02
 C   -2.295800      0.2632000      0.2377000    
 C    3.984900      -1.756800     -0.4860000    
 C   -2.796600      0.3575000      -1.039400    
 C   -3.093900      4.6599999E-02   1.338000    
 C    2.052900       3.726600      0.3995000    
 C    3.736300       2.146400       1.064500    
 C   -4.172500      0.2280000      -1.228400    
 C   -5.009100      7.8999996E-03 -0.1342000    
 C   -4.469900     -8.2800001E-02   1.149100    
 C   -1.923800      0.5959000      -2.228200    
 C   -6.480400     -0.1310000     -0.3351000    
 H    2.707800       1.912900      -1.404000    
 H    1.077800       1.665500     -0.9609000    
 H   -1.269200      -2.457400       1.146100    
 H    3.266000      -3.722500      9.5899999E-02
 H    4.988200      -2.117400     -0.7027000    
 H   -2.679900     -2.2600001E-02   2.339400    
 H    1.009500       3.860800      9.4099998E-02
 H    2.695200       4.162400     -0.3745000    
 H    2.184600       4.303800       1.321400    
 H    3.950900       1.141300       1.437900    
 H    3.922200       2.793600       1.931800    
 H    4.461300       2.444200      0.2998000    
 H   -4.598500      0.2997000      -2.226500    
 H   -5.111200     -0.2519000       2.010000    
 H   -1.358700       1.526400      -2.110800    
 H   -1.226800     -0.2370000      -2.366200    
 H   -2.507700      0.6881000      -3.150500    
 H    5.467600     -5.7599999E-02  -1.227500    
 H   -6.703500     -0.6033000      -1.297800    
 H   -6.929400     -0.7597000      0.4413000    
 H   -6.957800      0.8535000     -0.3072000    


%chk=000029536-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029536

0 1
O 1.297516 -3.267670 -0.143289
O 5.125290 0.789662 -0.069554
O -0.022999 0.517511 -2.307468
N 1.192066 1.773571 0.185322
C 1.952335 -1.054770 -0.437776
C 2.860365 0.034913 -0.399114
C 2.386300 1.453911 -0.645242
C 0.514081 -1.149218 -0.677831
C 2.392884 -2.367791 -0.117408
C 4.206194 -0.284436 -0.096145
C -0.384377 -0.091402 -1.244669
C 0.176140 -2.477093 -0.476610
C 3.719037 -2.689352 0.192924
C -1.727314 0.119933 -0.615613
C 4.634712 -1.615452 0.186024
C -2.830201 0.682151 -1.343234
C -1.908814 -0.223001 0.753719
C 0.490554 2.981126 -0.286870
C 1.459984 1.786074 1.635501
C -4.060082 0.856373 -0.661220
C -4.240367 0.524394 0.704902
C -3.137156 -0.023285 1.408270
C -2.749434 1.078655 -2.806281
C -5.568112 0.769504 1.398224
H 3.221562 2.167160 -0.469843
H 2.066718 1.545160 -1.701631
H -0.763866 -3.016445 -0.558065
H 4.028711 -3.709664 0.431606
H 5.690467 -1.807727 0.416519
H -1.058665 -0.633590 1.307762
H 0.188286 2.832867 -1.339138
H 1.114122 3.906738 -0.223058
H -0.421073 3.137556 0.317205
H 1.919914 0.829581 1.938543
H 0.507433 1.903576 2.183239
H 2.146261 2.612353 1.946077
H -4.910338 1.267982 -1.220474
H -3.244652 -0.291155 2.466112
H -2.112778 1.970507 -2.941771
H -2.281146 0.291971 -3.422379
H -3.757220 1.296336 -3.202102
H 6.028193 0.467757 0.172586
H -6.417184 0.658252 0.701070
H -5.719790 0.072199 2.240633
H -5.615157 1.796979 1.809547


