%chk=000038284.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038284

0 1
 O   0.5688000       1.421400     -0.7467000    
 O   -2.031300      -2.936000     -0.4220000    
 C  -0.6853000       1.067400     -0.3541000    
 C    1.626600      0.6504000     -0.2947000    
 C   -1.078100     -0.2704000     -0.3964000    
 C   -2.363900     -0.6328000      4.9999999E-03
 C   -1.578500       2.042700      8.9599997E-02
 C   -3.256900      0.3427000      0.4487000    
 C   -2.864200       1.680400      0.4911000    
 C    1.667900      0.2773000       1.036500    
 C    2.614500      0.2739000      -1.186400    
 C    2.733800     -0.4987000       1.491700    
 C    3.680400     -0.5023000     -0.7310000    
 C    3.740000     -0.8885000      0.6080000    
 C   -2.773700      -2.027500     -3.9500002E-02
 H  -0.3947000      -1.031700     -0.7651000    
 H   -1.278200       3.086400      0.1250000    
 H   -4.262100      7.6099999E-02  0.7648000    
 H   -3.559400       2.439900      0.8367000    
 H   0.9097000      0.5878000       1.749500    
 H    2.569200      0.5736000      -2.228900    
 H    2.783300     -0.7950000       2.535400    
 H    4.464100     -0.8056000      -1.419100    
 H    4.570500      -1.491700      0.9628000    
 H   -3.802300      -2.252200      0.2905000    


%chk=000038284-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038284

0 1
O 0.589480 1.416376 -0.430567
O -2.250426 -3.024690 0.179314
C -0.737194 1.015638 -0.169798
C 1.693731 0.570611 -0.125408
C -1.153527 -0.326568 -0.071268
C -2.532203 -0.605614 0.123176
C -1.677516 2.075026 -0.086971
C -3.479641 0.446951 0.210703
C -3.044718 1.786522 0.101087
C 1.805109 -0.107393 1.109941
C 2.732075 0.534417 -1.079279
C 2.977783 -0.847792 1.377841
C 3.901626 -0.204851 -0.794257
C 4.027304 -0.901342 0.430607
C -2.998555 -2.012264 0.231326
H -0.453683 -1.164755 -0.150484
H -1.316259 3.104091 -0.175704
H -4.540645 0.214651 0.361240
H -3.765434 2.608303 0.164356
H 0.999564 -0.052455 1.849012
H 2.612013 1.081572 -2.018996
H 3.071022 -1.377611 2.332032
H 4.711223 -0.238312 -1.531334
H 4.933399 -1.477148 0.646097
H -4.104327 -2.125763 0.368732


%chk=000038284-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000038284

0 1
O 0.589480 1.416376 -0.430567
O -2.250426 -3.024690 0.179314
C -0.737194 1.015638 -0.169798
C 1.693731 0.570611 -0.125408
C -1.153527 -0.326568 -0.071268
C -2.532203 -0.605614 0.123176
C -1.677516 2.075026 -0.086971
C -3.479641 0.446951 0.210703
C -3.044718 1.786522 0.101087
C 1.805109 -0.107393 1.109941
C 2.732075 0.534417 -1.079279
C 2.977783 -0.847792 1.377841
C 3.901626 -0.204851 -0.794257
C 4.027304 -0.901342 0.430607
C -2.998555 -2.012264 0.231326
H -0.453683 -1.164755 -0.150484
H -1.316259 3.104091 -0.175704
H -4.540645 0.214651 0.361240
H -3.765434 2.608303 0.164356
H 0.999564 -0.052455 1.849012
H 2.612013 1.081572 -2.018996
H 3.071022 -1.377611 2.332032
H 4.711223 -0.238312 -1.531334
H 4.933399 -1.477148 0.646097
H -4.104327 -2.125763 0.368732


