%chk=000152838.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152838

0 1
 O    3.753900       1.270000      0.7709000    
 O   -1.094600     -0.3228000      -1.362700    
 O  -0.6103000       2.424500     -0.6569000    
 O    3.227500      -2.684200     -0.2151000    
 O   -2.693200       3.329400     -0.9321000    
 O   -4.633800      -2.287600       1.146900    
 O   -2.565300      -3.630000      0.1472000    
 C    4.898400      0.4298000      0.5428000    
 C    4.598400      -1.038900      0.8617000    
 C    2.327000     -0.5074000     -0.1066000    
 C    2.569900      0.8206000      0.2529000    
 C    3.377000      -1.516100      0.1231000    
 C    5.979600      0.9324000       1.511400    
 C    5.409700      0.6249000     -0.8947000    
 C    1.095100     -0.8838000     -0.6522000    
 C   9.2100002E-02  7.3899999E-02 -0.8066000    
 C    1.564500       1.775500      9.1899998E-02
 C   0.3317000       1.391300     -0.4359000    
 C   0.8098000      -2.282000      -1.105000    
 C   -2.169200     -0.1461000     -0.5289000    
 C   -2.617600       1.116900     -0.1427000    
 C   -3.745700       1.225500      0.6796000    
 C   -2.001600       2.364000     -0.6305000    
 C   -2.846900      -1.295100     -0.1108000    
 C   -3.962100      -1.182100      0.7175000    
 C   -4.409700      7.6899998E-02   1.114200    
 C   -4.275300       2.540000       1.159700    
 C   -2.409100      -2.619600     -0.5391000    
 H    4.390300      -1.175500       1.930100    
 H    5.449400      -1.673400      0.5899000    
 H    6.205300       1.989900       1.330700    
 H    5.634700      0.8654000       2.549800    
 H    6.907300      0.3585000       1.416400    
 H    6.333900      6.3800000E-02  -1.069400    
 H    4.674600      0.3043000      -1.640000    
 H    5.604600       1.684900      -1.094600    
 H    1.745200       2.813300      0.3597000    
 H   0.5989000      -2.939000     -0.2568000    
 H  -1.7400000E-02  -2.330400      -1.812300    
 H    1.627200      -2.683000      -1.712000    
 H   -5.282000      0.1596000       1.758700    
 H   -4.832300       3.045700      0.3648000    
 H   -4.962000       2.412000       2.004800    
 H   -3.469300       3.185300       1.524600    
 H   -1.981100      -2.696900      -1.548100    
 H   -5.377300      -2.011000       1.709600    


%chk=000152838-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152838

0 1
O 3.814850 1.388392 0.596349
O -1.154066 -0.417338 -1.355322
O -0.585369 2.350017 -0.864639
O 3.475345 -2.740887 0.009818
O -2.600155 3.369102 -0.777180
O -5.004369 -2.300128 0.869568
O -3.344089 -3.757295 -0.789694
C 5.055152 0.517693 0.518396
C 4.668670 -0.885311 1.024261
C 2.399688 -0.551508 -0.096540
C 2.616583 0.848605 0.138428
C 3.492559 -1.496930 0.254538
C 6.053217 1.217423 1.447020
C 5.537318 0.508517 -0.945697
C 1.123758 -0.994991 -0.599776
C 0.113224 -0.028552 -0.799430
C 1.593355 1.791542 -0.085270
C 0.349738 1.344632 -0.544027
C 0.854449 -2.449318 -0.919346
C -2.288998 -0.221948 -0.525599
C -2.605563 1.070303 -0.021672
C -3.725134 1.203361 0.870657
C -1.977644 2.313519 -0.560386
C -3.101632 -1.369579 -0.290005
C -4.204396 -1.201089 0.602039
C -4.473173 0.057438 1.193356
C -4.125001 2.530888 1.482972
C -2.827819 -2.634647 -1.028078
H 4.378518 -0.816798 2.092693
H 5.524133 -1.578240 0.952296
H 6.246219 2.246116 1.097325
H 5.659882 1.268703 2.476777
H 7.010745 0.667331 1.460918
H 6.465995 -0.083633 -1.032658
H 4.787870 0.064133 -1.623686
H 5.745104 1.538049 -1.282791
H 1.774433 2.856480 0.073387
H 0.976471 -3.084020 -0.024372
H -0.157124 -2.578221 -1.324384
H 1.588484 -2.833546 -1.646791
H -5.311464 0.153039 1.895340
H -4.610610 3.175269 0.729878
H -4.822822 2.375600 2.322546
H -3.252030 3.096839 1.850918
H -2.125774 -2.502826 -1.881268
H -5.758331 -2.052785 1.465033


