%chk=000010954.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010954

0 1
 O    2.788400      0.6330000       1.479600    
 C    1.060200       2.709900     -0.1940000    
 C    1.019400      -2.266200     -0.2552000    
 C  -9.8800004E-02   2.187000      -1.047200    
 C  -1.8800000E-02  -3.317000      0.1406000    
 C    2.446500       2.364800     -0.7516000    
 C    2.219600      -2.283900      0.6955000    
 C   -1.428400       2.890600     -0.7514000    
 C   -1.200200      -3.395700     -0.8312000    
 C    2.738500      0.8765000     -0.9286000    
 C    3.332600      -1.343300      0.2458000    
 C   -1.910500       2.815400      0.7019000    
 C   -2.021600      -2.111600     -0.9898000    
 C    2.938900      0.1166000      0.3733000    
 C   -2.249500       1.406900       1.205400    
 C   -2.624100      -1.614100      0.3251000    
 C   -3.422600      0.8028000      0.4868000    
 C   -3.569600     -0.4717000      9.4999999E-02
 H   0.9638000       2.329700      0.8285000    
 H   0.9955000       3.803300     -0.1268000    
 H   0.5628000      -1.271400     -0.2387000    
 H    1.357500      -2.455600      -1.281100    
 H  -0.2114000       1.107000     -0.9044000    
 H   0.1320000       2.340500      -2.108700    
 H  -0.3780000      -3.123100       1.157700    
 H   0.4621000      -4.303000      0.1688000    
 H    3.204800       2.810900     -9.6100003E-02
 H    2.555900       2.854100      -1.727700    
 H    2.626700      -3.301200      0.7452000    
 H    1.888200      -2.020400       1.707200    
 H   -2.197300       2.484600      -1.419400    
 H   -1.325800       3.949900      -1.019700    
 H   -1.866300      -4.202000     -0.4992000    
 H  -0.8280000      -3.692900      -1.819600    
 H    3.673400      0.7808000      -1.494100    
 H    1.950700      0.3860000      -1.507200    
 H    3.629800      -1.557900     -0.7865000    
 H    4.223900      -1.492800      0.8663000    
 H   -2.799400       3.452600      0.8001000    
 H   -1.156700       3.255400       1.365200    
 H   -2.827200      -2.315200      -1.707600    
 H   -1.406000      -1.324100      -1.440800    
 H   -2.512200       1.481700       2.267700    
 H   -1.359400      0.7745000       1.143000    
 H   -1.831800      -1.336800       1.025800    
 H   -3.186000      -2.426100      0.8028000    
 H   -4.246600       1.480800      0.2693000    
 H   -4.493800     -0.7281000     -0.4208000    


%chk=000010954-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010954

0 1
O 2.451665 0.413858 1.425648
C 1.112289 2.878620 -0.033708
C 0.951867 -2.477016 -0.300559
C 0.000413 2.405761 -1.001987
C -0.058464 -3.459902 0.332121
C 2.556375 2.585863 -0.517179
C 2.279374 -2.397105 0.487544
C -1.374258 3.076279 -0.746789
C -1.320877 -3.715604 -0.530570
C 2.857837 1.118014 -0.887404
C 3.248149 -1.329030 -0.078010
C -1.941835 2.905493 0.685462
C -2.130304 -2.449142 -0.907481
C 2.810615 0.106470 0.255889
C -2.267738 1.442543 1.086497
C -2.640843 -1.642611 0.316854
C -3.372685 0.826395 0.243759
C -3.536644 -0.486169 -0.078469
H 0.969803 2.420377 0.961025
H 1.019165 3.976266 0.104052
H 0.498990 -1.465892 -0.356500
H 1.161471 -2.785750 -1.346807
H -0.109879 1.303477 -0.942881
H 0.303370 2.629756 -2.047151
H -0.351885 -3.081489 1.331910
H 0.448766 -4.430891 0.510170
H 3.264282 2.904722 0.272700
H 2.768560 3.208992 -1.410232
H 2.773824 -3.388453 0.473824
H 2.072852 -2.151101 1.547132
H -2.109226 2.677927 -1.475258
H -1.278526 4.162057 -0.956431
H -1.986839 -4.418027 0.012261
H -1.016175 -4.231425 -1.464809
H 3.863050 1.035738 -1.354403
H 2.158498 0.753826 -1.670429
H 3.369440 -1.447957 -1.171918
H 4.252176 -1.465861 0.375667
H -2.869476 3.508785 0.770554
H -1.229328 3.329046 1.419457
H -3.001332 -2.752968 -1.523937
H -1.520987 -1.782494 -1.548765
H -2.582173 1.441386 2.152483
H -1.350056 0.825537 1.045432
H -1.786211 -1.278568 0.915515
H -3.208303 -2.335411 0.975891
H -4.135450 1.538513 -0.112391
H -4.412138 -0.761634 -0.688577


