%chk=000008791.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008791

0 1
 O   -3.625700     -0.3486000     -1.6000001E-02
 O   -2.401700      -2.298000      0.1322000    
 C    5.088400     -0.4354000     -7.0100002E-02
 C    3.758200      0.3177000     -0.1314000    
 C    6.313500      0.4828000     -0.1194000    
 C    2.572800     -0.6390000      1.5200000E-02
 C    7.675800     -0.2046000      2.6100000E-02
 C    1.240400      0.1074000     -7.8699999E-02
 C    8.853500      0.7731000      2.9300001E-02
 C   5.5500001E-02 -0.8570000      3.4100000E-02
 C    10.21670      7.8299999E-02  8.4500000E-02
 C   -1.291400     -0.1440000     -8.4100001E-02
 C    11.39360       1.041200      5.9400000E-02
 C   -2.473800      -1.082300      1.5600000E-02
 C   -4.838300      -1.100000      9.9799998E-02
 C   -6.005100     -0.1580000      4.8300002E-02
 C   -6.505200      0.3979000       1.226000    
 C   -6.589600      0.1623000      -1.177100    
 C   -7.589700       1.273800       1.178200    
 C   -7.674100       1.038200      -1.224800    
 C   -8.174000       1.594100     -4.7100000E-02
 H    5.143200      -1.150900     -0.8996000    
 H    5.127400      -1.022200      0.8562000    
 H    3.722800       1.067900      0.6677000    
 H    3.688000      0.8560000      -1.084200    
 H    6.297600       1.038500      -1.065600    
 H    6.218700       1.231100      0.6781000    
 H    2.635600      -1.159800      0.9784000    
 H    2.620900      -1.403500     -0.7698000    
 H    7.688700     -0.7853000      0.9565000    
 H    7.799100     -0.9206000     -0.7956000    
 H    1.180100      0.8584000      0.7181000    
 H    1.185000      0.6428000      -1.034200    
 H    8.757600       1.452200      0.8854000    
 H    8.806900       1.394000     -0.8739000    
 H   0.1043000      -1.387900      0.9932000    
 H   0.1304000      -1.622100     -0.7491000    
 H    10.30750     -0.6101000     -0.7642000    
 H    10.27600     -0.5305000      0.9945000    
 H   -1.350900      0.3704000      -1.049900    
 H   -1.378700      0.5983000      0.7177000    
 H    11.35760       1.723000      0.9149000    
 H    11.38860       1.639600     -0.8570000    
 H    12.33790      0.4896000      0.1018000    
 H   -4.841500      -1.654700       1.046400    
 H   -4.903100      -1.827600     -0.7189000    
 H   -6.057100      0.1578000       2.186500    
 H   -6.207700     -0.2626000      -2.101600    
 H   -7.978700       1.707100       2.095000    
 H   -8.128900       1.288200      -2.178900    
 H   -9.018200       2.276400     -8.4299996E-02


%chk=000008791-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008791

0 1
O -3.695212 -0.346245 -0.082540
O -2.482275 -2.265425 0.451548
C 5.171909 -0.399066 -0.010831
C 3.813614 0.337082 0.023139
C 6.387520 0.554829 0.003183
C 2.600301 -0.619525 0.011502
C 7.745047 -0.183253 -0.026808
C 1.241001 0.114317 0.050522
C 8.962198 0.768767 -0.012370
C 0.037057 -0.852517 0.049005
C 10.319095 0.028536 -0.041683
C -1.312035 -0.107762 0.083259
C 11.529838 0.986658 -0.026689
C -2.507077 -1.043676 0.174848
C -4.960535 -1.159612 0.020922
C -6.126137 -0.205176 -0.042337
C -6.534799 0.507323 1.114047
C -6.831588 -0.008077 -1.255439
C -7.623711 1.404133 1.057378
C -7.924061 0.886307 -1.315586
C -8.321913 1.595077 -0.158637
H 5.218982 -1.039097 -0.916854
H 5.236605 -1.087289 0.858022
H 3.767204 0.977450 0.929048
H 3.747853 1.024563 -0.846303
H 6.324928 1.241656 -0.866992
H 6.339624 1.196315 0.908208
H 2.668308 -1.308391 0.879271
H 2.645831 -1.258396 -0.895173
H 7.807211 -0.870145 0.843384
H 7.792875 -0.824935 -0.931732
H 1.199161 0.755937 0.956045
H 1.171019 0.800184 -0.819937
H 8.916221 1.410848 0.892388
H 8.902421 1.455570 -0.882823
H 0.098467 -1.534341 0.918316
H 0.077966 -1.498930 -0.849469
H 10.363880 -0.612572 -0.945905
H 10.377632 -0.657754 0.827916
H -1.441712 0.540187 -0.803718
H -1.352956 0.572198 0.958801
H 11.524824 1.616768 0.882945
H 11.509844 1.663537 -0.901859
H 12.486838 0.433322 -0.049236
H -4.918577 -1.725023 0.969017
H -4.962834 -1.882486 -0.813997
H -5.995179 0.359593 2.057310
H -6.522181 -0.554349 -2.154848
H -7.930990 1.949261 1.956790
H -8.462727 1.029237 -2.258873
H -9.169876 2.287786 -0.202575


