%chk=000044147.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044147

0 1
 O   -3.531500      -1.149600     -0.8203000    
 C   0.2280000      0.2606000      1.7600000E-02
 C  -4.9400002E-02  -1.137000      6.4999998E-02
 C  -0.9483000       1.183800      0.1141000    
 C    1.599100      0.6852000     -0.1001000    
 C   -1.351700      -1.654100     -9.2000000E-02
 C   0.9983000      -2.067000      0.2439000    
 C   -2.244600      0.7151000     -0.1766000    
 C    2.630600     -0.2691000      9.6799999E-02
 C   -2.458800     -0.7282000     -0.4083000    
 C    2.315500      -1.613500      0.3063000    
 C   -1.620400      -3.026200     -1.6200000E-02
 C   0.7205000      -3.441300      0.3395000    
 C  -0.8710000       2.504000      0.5955000    
 C    2.031800       1.992300     -0.4504000    
 C  -0.5815000      -3.916800      0.2161000    
 C   -3.370000       1.554100     -0.1438000    
 C    3.984700      0.1089000      5.6899998E-02
 C   -1.987900       3.347400      0.6422000    
 C    3.380900       2.355700     -0.5036000    
 C   -3.233300       2.879500      0.2477000    
 C    4.359100       1.416200     -0.2304000    
 H    3.119500      -2.335400      0.4543000    
 H   -2.628400      -3.413300     -0.1359000    
 H    1.523900      -4.159200      0.4937000    
 H   5.8600001E-02   2.912100      0.9820000    
 H    1.319300       2.760800     -0.7368000    
 H  -0.7804000      -4.982300      0.2816000    
 H   -4.361600       1.180100     -0.3840000    
 H    4.769600     -0.6256000      0.2306000    
 H   -1.879800       4.366600       1.002200    
 H    3.658400       3.371400     -0.7695000    
 H   -4.100800       3.531000      0.2875000    
 H    5.409000       1.689200     -0.2683000    


%chk=000044147-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044147

0 1
O -3.693880 -1.182228 -0.678501
C 0.217353 0.253711 0.033395
C -0.054939 -1.153410 0.065998
C -0.937652 1.178550 0.123465
C 1.591806 0.686451 -0.074056
C -1.394272 -1.670946 -0.102182
C 1.025407 -2.112943 0.238653
C -2.264723 0.697993 -0.142513
C 2.666180 -0.282331 0.145070
C -2.535773 -0.749627 -0.353864
C 2.356269 -1.647529 0.339043
C -1.636924 -3.052165 -0.067616
C 0.725318 -3.517845 0.306581
C -0.817840 2.532361 0.562814
C 1.991446 2.014757 -0.472011
C -0.580755 -3.982125 0.157183
C -3.376749 1.578499 -0.110500
C 4.040584 0.152879 0.119219
C -1.931306 3.391510 0.616254
C 3.331772 2.391500 -0.531094
C -3.217520 2.928887 0.241611
C 4.373203 1.464947 -0.191196
H 3.167235 -2.362919 0.524302
H -2.666524 -3.390165 -0.226928
H 1.552954 -4.220222 0.462310
H 0.145617 2.901071 0.921208
H 1.229635 2.724303 -0.801737
H -0.798423 -5.053960 0.201147
H -4.359385 1.154167 -0.341550
H 4.822346 -0.589160 0.320782
H -1.799664 4.421256 0.967194
H 3.596341 3.401170 -0.864251
H -4.079578 3.603369 0.267911
H 5.419842 1.785597 -0.218842


