%chk=000012844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012844

0 1
 O    2.064200     -0.6504000      4.6000000E-02
 O    3.433700      -2.438400      6.0699999E-02
 C    1.845700      0.7276000     -0.3324000    
 C   0.4931000       1.147000      0.2271000    
 C    2.953400       1.648100      0.1546000    
 C  -0.6299000      0.2480000     -0.2898000    
 C   -1.982900      0.6514000      0.3010000    
 C    4.278800       1.092900     -0.3245000    
 C   -3.110400     -0.2259000     -0.2477000    
 C    4.476000     -0.2982000      0.2405000    
 C   -4.498400      0.1802000      0.2559000    
 C    3.294000      -1.217300      6.6500001E-02
 C   -5.631600     -0.6491000     -0.3494000    
 C   -6.985700     -0.2159000      0.1914000    
 H    1.801500      0.7502000      -1.428800    
 H   0.5132000       1.084000       1.322600    
 H   0.2846000       2.190300     -3.8899999E-02
 H    2.957000       1.700300       1.250400    
 H    2.805600       2.664700     -0.2263000    
 H  -0.6728000      0.3103000      -1.384000    
 H  -0.4322000     -0.7995000     -3.3599999E-02
 H   -1.952200      0.5680000       1.394000    
 H   -2.188700       1.701800      6.1700001E-02
 H    5.100600       1.745100     -9.2000002E-03
 H    4.294400       1.057900      -1.420800    
 H   -2.921600      -1.272400      2.1800000E-02
 H   -3.103400     -0.1755000      -1.343800    
 H    4.683400     -0.2397000       1.315300    
 H    5.343300     -0.7584000     -0.2459000    
 H   -4.667000       1.239600      2.5200000E-02
 H   -4.522200      8.7399997E-02   1.348900    
 H   -5.475100      -1.710400     -0.1244000    
 H   -5.627000     -0.5438000      -1.440400    
 H   -7.032100     -0.3394000       1.278100    
 H   -7.184600      0.8344000     -4.4300001E-02
 H   -7.782100     -0.8207000     -0.2534000    


%chk=000012844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012844

0 1
O 2.088636 -0.675342 0.027637
O 3.404953 -2.468885 0.497584
C 1.889794 0.765051 -0.384925
C 0.510450 1.161594 0.158557
C 3.040562 1.663978 0.088751
C -0.652143 0.336936 -0.436022
C -2.014986 0.675231 0.207581
C 4.397480 1.051882 -0.313431
C -3.187265 -0.126356 -0.401883
C 4.567034 -0.322368 0.365536
C -4.546511 0.166185 0.272514
C 3.344516 -1.240370 0.284966
C -5.719786 -0.627014 -0.347355
C -7.071930 -0.342165 0.341762
H 1.868554 0.743186 -1.494644
H 0.524735 1.049119 1.260998
H 0.355129 2.239535 -0.055605
H 2.989121 1.795508 1.188034
H 2.908647 2.662760 -0.368212
H -0.707625 0.514429 -1.530858
H -0.431414 -0.738458 -0.299880
H -1.962637 0.472259 1.297793
H -2.220348 1.761856 0.102652
H 5.232348 1.716836 -0.027551
H 4.437752 0.938117 -1.414775
H -2.965882 -1.211065 -0.323595
H -3.260283 0.097837 -1.486895
H 4.774643 -0.185499 1.446015
H 5.421067 -0.888865 -0.043589
H -4.765405 1.252898 0.206866
H -4.477398 -0.071558 1.354842
H -5.495275 -1.711723 -0.289736
H -5.794255 -0.382668 -1.426876
H -7.033118 -0.609795 1.414711
H -7.333210 0.730995 0.274020
H -7.893350 -0.919861 -0.120887


