%chk=000027868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027868

0 1
 O  -0.1447000     -0.7789000      6.8899997E-02
 O   -1.746900      -1.095200      -1.560500    
 C    2.116400      7.0900001E-02 -0.1781000    
 C   0.7204000     -6.2600002E-02 -0.8108000    
 C    2.077700      0.9674000       1.068700    
 C   7.5999998E-02   2.212400      0.1326000    
 C   0.1133000       1.311100      -1.111900    
 C    1.470800       2.334900      0.7591000    
 C    2.711600      -1.294200      0.1723000    
 C  -0.4787000       3.592000     -0.2191000    
 C    2.721100      -2.203100      -1.053400    
 C    4.120700      -1.133800      0.7358000    
 C   -1.418100     -0.9805000     -0.3867000    
 C   -2.383400      -1.012300      0.7860000    
 C   -3.762300     -0.4614000      0.3947000    
 C   -2.492900      -2.452300       1.279400    
 C   -3.701000      0.9858000     -7.7100001E-02
 H    2.767400      0.5599000     -0.9175000    
 H   0.7910000     -0.6062000      -1.760200    
 H    3.083600       1.148000       1.460500    
 H    1.501900      0.4856000       1.868900    
 H  -0.5963000       1.763500      0.8747000    
 H  -0.8921000       1.237800      -1.534700    
 H   0.7265000       1.796500      -1.883500    
 H    1.413600       2.921900       1.683700    
 H    2.138600       2.880000      7.9499997E-02
 H    2.104900      -1.785100      0.9445000    
 H   -1.488300       3.510200     -0.6354000    
 H  -0.5346000       4.226300      0.6718000    
 H   0.1518000       4.099200     -0.9571000    
 H    3.285000      -3.120400     -0.8488000    
 H    3.188800      -1.714000      -1.914700    
 H    1.713300      -2.522100      -1.336100    
 H    4.610700      -2.109500      0.8321000    
 H    4.747600     -0.5132000      8.6499996E-02
 H    4.115200     -0.6968000       1.738700    
 H   -1.977500     -0.3828000       1.588000    
 H   -4.211700      -1.073500     -0.3970000    
 H   -4.432300     -0.5193000       1.261100    
 H   -1.511500      -2.840100       1.573900    
 H   -3.156300      -2.518000       2.147900    
 H   -2.885600      -3.112400      0.4979000    
 H   -3.207900       1.622000      0.6643000    
 H   -4.715400       1.370200     -0.2268000    
 H   -3.173900       1.084200      -1.029000    


%chk=000027868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027868

0 1
O -0.321173 -0.297331 0.163985
O -1.605807 -1.212257 -1.557849
C 2.061158 0.187690 -0.138055
C 0.685225 0.214125 -0.842302
C 2.102296 1.251958 0.993278
C 0.289453 2.663313 -0.155104
C 0.252457 1.619607 -1.296142
C 1.692662 2.659330 0.498604
C 2.459736 -1.240198 0.355435
C -0.103326 4.064098 -0.667204
C 2.341216 -2.307224 -0.762230
C 3.896746 -1.261887 0.934610
C -1.424073 -0.990644 -0.335561
C -2.354729 -1.444668 0.786363
C -3.765542 -0.821934 0.584351
C -2.424980 -2.993885 0.795184
C -3.784731 0.718963 0.673350
H 2.796909 0.488214 -0.919733
H 0.653485 -0.474600 -1.704832
H 3.118584 1.301308 1.424986
H 1.418428 0.931854 1.804847
H -0.445204 2.347776 0.615440
H -0.756618 1.559260 -1.746766
H 0.943240 1.940842 -2.104599
H 1.716566 3.375511 1.343817
H 2.434550 3.020948 -0.246134
H 1.754199 -1.514576 1.166596
H -1.115780 4.061919 -1.113334
H -0.096428 4.806366 0.153049
H 0.605848 4.413350 -1.443129
H 2.699062 -3.287149 -0.395402
H 2.959388 -2.033396 -1.639939
H 1.301763 -2.446384 -1.108184
H 4.175118 -2.288692 1.236548
H 4.631906 -0.924506 0.177380
H 4.003333 -0.616291 1.823755
H -1.931307 -1.085564 1.742423
H -4.152933 -1.149195 -0.399844
H -4.436572 -1.248380 1.355760
H -1.431940 -3.445204 0.972360
H -3.105962 -3.336856 1.594948
H -2.805230 -3.365347 -0.172869
H -3.393750 1.068955 1.647110
H -4.813357 1.106853 0.560494
H -3.167384 1.176030 -0.122360


