%chk=000091924.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091924

0 1
 O   -1.867000     -0.3207000      0.4436000    
 O   -1.069200      -1.346100      -1.463200    
 C    1.528700     -0.5943000     -4.1200001E-02
 C    1.332500      0.9179000     -0.2155000    
 C    2.758100     -0.8890000      0.8286000    
 C    2.589300       1.589700     -0.7638000    
 C    4.012600     -0.2139000      0.2788000    
 C    3.810800       1.287400      9.8499998E-02
 C   0.2780000      -1.235000      0.5579000    
 C  -0.9390000     -0.9947000     -0.2986000    
 C   -3.090700     -1.3000000E-02 -0.2320000    
 C   -4.007500      0.7319000      0.7262000    
 C   -5.336800       1.079700      8.0600001E-02
 H    1.699900      -1.029200      -1.035800    
 H    1.071000       1.374300      0.7479000    
 H   0.5041000       1.127700     -0.9017000    
 H    2.925400      -1.971200      0.8849000    
 H    2.582400     -0.5408000       1.854600    
 H    2.434900       2.673500     -0.8159000    
 H    2.770800       1.243200      -1.788700    
 H    4.276600     -0.6653000     -0.6855000    
 H    4.854800     -0.3938000      0.9566000    
 H    4.703900       1.727400     -0.3595000    
 H    3.689600       1.759700       1.081100    
 H   0.1028000     -0.8503000       1.570600    
 H   0.4005000      -2.320000      0.6553000    
 H   -3.565700     -0.9449000     -0.5606000    
 H   -2.873500      0.6103000      -1.107300    
 H   -4.177000      0.1222000       1.621700    
 H   -3.511200       1.645900       1.073900    
 H   -5.866300      0.1763000     -0.2382000    
 H   -5.975100       1.614500      0.7909000    
 H   -5.191800       1.720500     -0.7950000    


%chk=000091924-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091924

0 1
O -2.103779 -0.133239 0.528633
O -0.988994 -0.545594 -1.474083
C 1.579177 -0.340280 0.010998
C 1.722860 1.187821 -0.209422
C 2.763283 -0.881087 0.851831
C 3.085506 1.548614 -0.847448
C 4.128246 -0.521893 0.217808
C 4.262407 1.003653 -0.003942
C 0.230279 -0.696702 0.678848
C -0.968875 -0.455230 -0.223967
C -3.368379 0.070016 -0.241895
C -4.459388 0.427791 0.767993
C -5.818834 0.652787 0.068830
H 1.602053 -0.830680 -0.984597
H 1.631445 1.702732 0.771247
H 0.896688 1.553858 -0.849069
H 2.674247 -1.980723 0.964270
H 2.711048 -0.449028 1.874414
H 3.171481 2.646728 -0.962192
H 3.135443 1.115120 -1.867737
H 4.223247 -1.039972 -0.759037
H 4.953077 -0.891123 0.858049
H 5.227287 1.235345 -0.495599
H 4.271937 1.515296 0.981255
H 0.087015 -0.140271 1.622997
H 0.222414 -1.774679 0.944346
H -3.597871 -0.860923 -0.793807
H -3.202818 0.874453 -0.982750
H -4.543936 -0.385174 1.513245
H -4.158175 1.338411 1.318855
H -6.152122 -0.256608 -0.465308
H -6.598853 0.915312 0.805077
H -5.761217 1.475168 -0.668642


