%chk=000028498.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028498

0 1
 O   -1.204200       2.541300       1.264100    
 O  -7.5000003E-02   1.800800     -0.6083000    
 C    3.041200     -0.3885000     -0.2337000    
 C    4.518100     -1.9099999E-02 -0.4088000    
 C    2.722300      -1.813500     -0.6996000    
 C    4.856900       1.380100      0.1111000    
 C    1.289700      -2.200000     -0.4640000    
 C    6.334200       1.724900      8.6000003E-03
 C   0.9152000      -3.191800      0.3599000    
 C  -0.4827000      -3.664000      0.6590000    
 C   -1.579300      -2.938400     -6.4900003E-02
 C   -3.700300      -1.531500     -0.2461000    
 C   -3.498400       2.361200     -0.5379000    
 C   -2.602500      -2.257900      0.4751000    
 C   -2.151400       3.011000     -0.8444000    
 C   -3.503800      0.8940000     -0.8590000    
 C   -3.674900     -6.4099997E-02  6.3699998E-02
 C   -1.016500       2.375400     -7.6300003E-02
 C  -0.1886000       1.980000       2.101500    
 H    2.422600      0.3264000     -0.7903000    
 H    2.769000     -0.2839000      0.8245000    
 H    4.785400     -8.6000003E-02  -1.470500    
 H    5.135900     -0.7552000      0.1206000    
 H    2.930800      -1.900200      -1.772900    
 H    3.396000      -2.516900     -0.1946000    
 H    4.277100       2.124400     -0.4476000    
 H    4.550000       1.461700       1.160800    
 H   0.5476000      -1.625000      -1.010100    
 H    6.940100       1.023800      0.5912000    
 H    6.671700       1.688000      -1.032000    
 H    6.517100       2.733800      0.3913000    
 H    1.694800      -3.740300      0.8865000    
 H  -0.6401000      -3.595600       1.742300    
 H  -0.5478000      -4.727200      0.3983000    
 H   -1.540600      -2.997800      -1.152100    
 H   -4.276700       2.850700      -1.135200    
 H   -3.761700       2.528300      0.5137000    
 H   -3.626800      -1.705300      -1.326400    
 H   -4.664700      -1.943500      7.3299997E-02
 H   -2.656400      -2.218200       1.562700    
 H   -1.924800       2.928800      -1.914400    
 H   -2.173500       4.080600     -0.6070000    
 H   -3.366100      0.6177000      -1.901300    
 H   -3.822400      0.2209000       1.103200    
 H  -0.1352000      0.8966000       1.956400    
 H  -0.4553000       2.182100       3.142100    
 H   0.7784000       2.446100       1.889200    


%chk=000028498-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028498

0 1
O -0.976312 2.259984 1.107298
O 0.107579 1.643224 -0.857151
C 3.003160 -0.319725 0.077290
C 4.428656 0.124382 -0.317952
C 2.632661 -1.714562 -0.496088
C 4.814836 1.511210 0.246438
C 1.200725 -2.117104 -0.211773
C 6.234676 1.956438 -0.166098
C 0.828610 -3.255668 0.431227
C -0.601847 -3.700584 0.717362
C -1.666930 -2.951373 -0.055492
C -3.765064 -1.513055 -0.283950
C -3.372687 2.425314 -0.578242
C -2.704150 -2.273219 0.498920
C -1.968646 2.989625 -0.958057
C -3.504169 0.952741 -0.909690
C -3.706385 -0.022961 0.012853
C -0.837373 2.232155 -0.282126
C 0.040784 1.494989 1.870943
H 2.266321 0.425329 -0.282507
H 2.916739 -0.349588 1.183715
H 4.507926 0.148223 -1.425364
H 5.165151 -0.630657 0.030307
H 2.789263 -1.681105 -1.596193
H 3.328568 -2.481849 -0.100187
H 4.074391 2.260802 -0.100134
H 4.740918 1.487471 1.353425
H 0.426836 -1.418128 -0.566945
H 6.994699 1.234811 0.189185
H 6.323753 2.020700 -1.267117
H 6.487944 2.948268 0.252182
H 1.615112 -3.940474 0.788297
H -0.805060 -3.621855 1.806339
H -0.673593 -4.784675 0.479786
H -1.568456 -2.975272 -1.152151
H -4.130196 3.017865 -1.129754
H -3.545138 2.585389 0.500656
H -3.634878 -1.688629 -1.368142
H -4.769229 -1.901591 -0.008310
H -2.792099 -2.233634 1.596937
H -1.800017 2.922085 -2.046209
H -1.913520 4.054966 -0.663872
H -3.385561 0.674682 -1.969054
H -3.805350 0.263252 1.072304
H 0.024282 0.434311 1.568353
H -0.249911 1.615248 2.924009
H 1.047385 1.906946 1.686432


