%chk=000030544.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030544

0 1
 O   -2.375400      -3.175000       1.019500    
 C   0.4983000      4.3800000E-02 -4.8300002E-02
 C    1.919600      0.1154000     -1.4800000E-02
 C  -0.1174000      -1.222700     -0.1472000    
 C  -0.2952000       1.220200      1.6200000E-02
 C   -1.511600      -1.312900     -0.1815000    
 C   -1.728800       1.110600     -2.0099999E-02
 C   -2.320200     -0.1733000     -0.1198000    
 C    2.700700      -1.064200     -7.9599999E-02
 C    2.565600       1.366600      8.3700001E-02
 C   0.6701000      -2.380300     -0.2102000    
 C   0.3954000       2.449900      0.1142000    
 C    2.061000      -2.303000     -0.1771000    
 C    1.790300       2.523900      0.1472000    
 C   -2.154400      -2.672400     -0.2868000    
 C   -2.615500       2.216000      3.7999999E-02
 C   -3.718500     -0.3157000     -0.1575000    
 C    4.100100     -0.9747000     -4.5400001E-02
 C    3.966900       1.428300      0.1161000    
 C    4.728200      0.2643000      5.1899999E-02
 C   -4.003700       2.061100     -3.0000001E-04
 C   -4.555700      0.7938000     -9.8200001E-02
 H   0.2691000      -3.386600     -0.2525000    
 H  -0.1410000       3.393800      0.1680000    
 H    2.639100      -3.223800     -0.2210000    
 H    2.259100       3.503000      0.2236000    
 H   -3.093500      -2.674300     -0.8459000    
 H   -1.564400      -3.392100     -0.8600000    
 H   -2.241200       3.233600      0.1157000    
 H   -4.232700      -1.269200     -0.1964000    
 H    4.714500      -1.871200     -9.4300002E-02
 H    4.478100       2.385700      0.1918000    
 H    5.812400      0.3227000      7.7600002E-02
 H   -4.648000       2.934100      4.8700001E-02
 H   -5.633800      0.6677000     -0.1200000    
 H   -2.787900      -4.050400      0.9244000    


%chk=000030544-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030544

0 1
O -2.676472 -3.273232 0.862917
C 0.511969 0.016319 -0.052286
C 1.951183 0.117723 -0.014367
C -0.119081 -1.295222 -0.132614
C -0.289753 1.204468 -0.018400
C -1.530544 -1.404004 -0.208710
C -1.737102 1.092121 -0.019000
C -2.348738 -0.219340 -0.100714
C 2.772623 -1.067831 -0.027888
C 2.590506 1.409205 0.037840
C 0.745412 -2.464996 -0.123348
C 0.378718 2.482126 0.026189
C 2.118759 -2.358626 -0.069755
C 1.760024 2.584168 0.051555
C -2.199325 -2.741722 -0.440319
C -2.592006 2.239672 0.067550
C -3.783329 -0.312906 -0.058631
C 4.184180 -0.946134 0.011126
C 4.013466 1.492148 0.072003
C 4.800168 0.326531 0.059119
C -3.982812 2.117770 0.085098
C -4.585070 0.824658 0.029823
H 0.292256 -3.459612 -0.119787
H -0.213237 3.400950 0.039117
H 2.742656 -3.259996 -0.048400
H 2.240413 3.568979 0.084621
H -3.056122 -2.618235 -1.134026
H -1.498906 -3.457219 -0.909643
H -2.155069 3.239962 0.130983
H -4.253168 -1.299676 -0.049126
H 4.798659 -1.854013 0.004478
H 4.488111 2.479559 0.109679
H 5.892469 0.402543 0.087481
H -4.611552 3.012134 0.155148
H -5.675483 0.728025 0.072488
H -3.144201 -4.133599 0.699500


