%chk=000104569.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104569

0 1
 O   0.8159000       2.822000     -2.2000000E-02
 C   -1.575200      0.9607000      3.8699999E-02
 C   -1.218600      -1.538200      3.8500000E-02
 C   -2.221100     -0.4064000      0.4004000    
 C  -0.1091000      0.6035000      3.4899998E-02
 C   8.9100003E-02 -0.7849000      3.4800000E-02
 C   -1.921300       2.010800       1.103400    
 C   -2.023600       1.464600      -1.338700    
 C   -1.257000      -2.643300       1.103100    
 C   -1.508100      -2.147200      -1.338900    
 C   0.9754000       1.472800      7.0000002E-03
 C    1.373400      -1.316300      6.6999998E-03
 C    2.463600     -0.4450000     -1.3400000E-02
 C    2.265800      0.9413000     -1.3300000E-02
 C    3.850700     -0.9944000     -4.1200001E-02
 H   -3.195500     -0.5455000     -8.3400004E-02
 H   -2.418400     -0.4341000       1.482200    
 H   -1.516900       1.738100       2.085300    
 H   -1.531400       3.002300      0.8518000    
 H   -3.008100       2.110400       1.206900    
 H   -1.552600       2.423500      -1.584700    
 H   -1.762600      0.7701000      -2.142200    
 H   -3.108900       1.613300      -1.365600    
 H  -0.5492000      -3.448200      0.8744000    
 H  -0.9972000      -2.255900       2.095300    
 H   -2.256200      -3.088500       1.167700    
 H   -1.456200      -1.406700      -2.142100    
 H  -0.7820000      -2.931300      -1.584300    
 H   -2.506000      -2.599000      -1.365200    
 H    1.523700      -2.391600     -6.0999999E-03
 H    3.126600       1.606200     -3.7999999E-02
 H    4.196400      -1.088900      -1.075400    
 H    4.542800     -0.3434000      0.5037000    
 H    3.896900      -1.979800      0.4347000    
 H    1.690100       3.247500     -4.3400001E-02


%chk=000104569-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000104569

0 1
O 0.771271 2.865261 -0.102488
C -1.612731 0.980823 0.053718
C -1.237215 -1.548618 0.057621
C -2.280913 -0.412882 0.354125
C -0.124753 0.617017 0.034147
C 0.091201 -0.779685 0.060330
C -1.962348 2.008054 1.163960
C -2.050493 1.554646 -1.325969
C -1.285368 -2.657385 1.139413
C -1.470566 -2.192698 -1.341325
C 0.997881 1.470518 -0.038889
C 1.392098 -1.327241 0.040589
C 2.519429 -0.469005 -0.010725
C 2.307369 0.933048 -0.049919
C 3.930779 -1.032106 -0.053885
H -3.209954 -0.550185 -0.229360
H -2.556484 -0.450883 1.425493
H -1.632732 1.645301 2.155171
H -1.472216 2.977485 0.972302
H -3.057130 2.166753 1.203470
H -1.501249 2.487060 -1.547288
H -1.853547 0.836838 -2.142684
H -3.133514 1.782486 -1.320598
H -0.545512 -3.454381 0.935469
H -1.073436 -2.243594 2.142093
H -2.286397 -3.128209 1.165281
H -1.465565 -1.430517 -2.140803
H -0.679203 -2.930055 -1.572874
H -2.445571 -2.715535 -1.367168
H 1.540949 -2.413346 0.069547
H 3.174739 1.607970 -0.090781
H 4.279696 -1.158460 -1.097563
H 4.651701 -0.366894 0.454237
H 3.982226 -2.022488 0.431268
H 1.632757 3.349412 -0.154312


