%chk=000105788.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105788

0 1
 O    2.241000     -0.4334000     -0.6729000    
 O   -2.184500      6.5800004E-02 -0.6227000    
 O    2.136700      0.6779000      -2.686100    
 O  -0.6691000     -0.1974000      -2.335300    
 O   0.8248000       5.550800       1.850000    
 O    2.902100       4.897400       1.198500    
 C    1.062900       1.580500     -0.7581000    
 C  -0.3256000       1.477300     -0.6731000    
 C    1.722400       2.642700     -0.1397000    
 C   0.9937000       3.601500      0.5640000    
 C   -1.054400       2.436200      3.0200001E-02
 C  -0.3948000       3.498400      0.6490000    
 C    1.852400      0.5951000      -1.485600    
 C    3.026600      -1.468300      -1.274000    
 C   -2.979200      -1.002400      -1.148900    
 C   -1.043600      0.3795000      -1.307700    
 C    3.354500      -2.500200     -0.2352000    
 C   -4.179600      -1.198700     -0.2704000    
 C    4.513700      -2.371300      0.5218000    
 C    2.496200      -3.576600     -3.9000001E-02
 C   -4.110800      -2.080300      0.8028000    
 C   -5.350300     -0.4976000     -0.5372000    
 C    1.681200       4.708500       1.209400    
 C    4.818400      -3.330900       1.487200    
 C    2.800900      -4.536000      0.9267000    
 C   -5.226800      -2.262800       1.619300    
 C   -6.466300     -0.6800000      0.2794000    
 C    3.962000      -4.413100       1.689800    
 C   -6.404500      -1.562700       1.357800    
 H    2.805600       2.715800     -0.2105000    
 H   -2.138100       2.393300      0.1035000    
 H   -1.001100       4.224100       1.183800    
 H    3.947300      -1.039000      -1.688200    
 H    2.465800      -1.924100      -2.099500    
 H   -2.381600      -1.921700      -1.188000    
 H   -3.291900     -0.7598000      -2.172100    
 H    5.186600      -1.531200      0.3739000    
 H    1.587800      -3.680600     -0.6261000    
 H   -3.197800      -2.629000       1.017000    
 H   -5.408700      0.1942000      -1.373100    
 H    5.722100      -3.235000       2.081800    
 H    2.133800      -5.378300       1.084900    
 H   -5.178700      -2.949600       2.459300    
 H   -7.383100     -0.1344000      7.6200001E-02
 H    4.199100      -5.159900       2.442000    
 H   -7.273300      -1.704600       1.993900    
 H    1.298200       6.294000       2.281300    


%chk=000105788-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000105788

0 1
O 2.120309 -0.071738 0.097829
O -1.860386 0.393531 -0.936082
O 3.512617 1.222196 -1.261732
O 0.145698 -0.182229 -1.994783
O 0.413933 6.739846 0.655775
O 2.637528 6.066641 0.673472
C 1.373069 2.120604 -0.509755
C -0.020518 1.893474 -0.708543
C 1.819850 3.406040 -0.136152
C 0.896440 4.455689 0.084637
C -0.939266 2.948549 -0.474896
C -0.491762 4.220283 -0.074113
C 2.434080 1.061881 -0.644522
C 3.113594 -1.202248 0.007465
C -2.520137 -0.861169 -1.449125
C -0.522372 0.598658 -1.275055
C 2.395573 -2.495495 0.301311
C -3.160967 -1.592224 -0.293681
C 2.707198 -3.242710 1.463510
C 1.423044 -2.994898 -0.604277
C -2.354421 -2.253022 0.668656
C -4.570652 -1.636615 -0.163342
C 1.429959 5.786338 0.490355
C 2.062853 -4.474995 1.719739
C 0.775356 -4.222258 -0.346157
C -2.951494 -2.942264 1.745188
C -5.170419 -2.332364 0.911137
C 1.095331 -4.967494 0.814637
C -4.361078 -2.985417 1.868547
H 2.889513 3.598795 -0.007425
H -2.004188 2.754917 -0.623832
H -1.198870 5.033876 0.105665
H 3.911734 -0.994271 0.741474
H 3.549942 -1.174481 -1.006813
H -1.740982 -1.457615 -1.955708
H -3.268203 -0.520686 -2.184777
H 3.454955 -2.861029 2.169604
H 1.171128 -2.409210 -1.496048
H -1.262364 -2.225864 0.576900
H -5.200677 -1.125044 -0.901702
H 2.314778 -5.046873 2.619727
H 0.026219 -4.602596 -1.049783
H -2.319394 -3.448096 2.483375
H -6.261796 -2.362534 1.002263
H 0.596139 -5.923436 1.009263
H -4.823692 -3.523306 2.703678
H 0.824796 7.604962 0.924193


