%chk=000147386.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147386

0 1
 O  -0.4772000      -1.405900     -1.0200000E-02
 O    3.465700      -3.161000     -0.5790000    
 O    3.524700       1.087700      0.6453000    
 O  -0.5790000       3.434400      0.4429000    
 O   -2.737600       2.003600      8.1000000E-02
 O   -4.904800      0.5861000     -0.2826000    
 O    3.722400       1.305300      -1.677100    
 C    1.497500     -0.1647000      0.3146000    
 C    2.261000      -1.409700      0.2743000    
 C   0.1089000     -0.1771000      0.1683000    
 C    2.566400      -2.229100       1.459900    
 C  -0.6002000       1.023100      0.2096000    
 C    2.168900       1.044400      0.5002000    
 C    3.353400      -3.380600      0.8385000    
 C   6.7699999E-02   2.236400      0.3955000    
 C   -2.670700     -0.3400000     -0.1384000    
 C   -2.062400      0.9855000      5.3500000E-02
 C   -1.841200      -1.461000     -0.1591000    
 C    2.783900      -1.983900     -0.7914000    
 C    1.455100       2.242500      0.5402000    
 C   -4.052200     -0.4762000     -0.2970000    
 C   -2.397400      -2.729000     -0.3400000    
 C   -4.602000      -1.745600     -0.4772000    
 C   -3.776500      -2.869900     -0.4988000    
 C  -0.7555000       4.125100     -0.7924000    
 C    4.223800       1.226700     -0.5634000    
 C   -5.442600      0.9686000      0.9817000    
 C    5.699800       1.264200     -0.2985000    
 H    3.174000      -1.689600       2.193800    
 H    1.664300      -2.595100       1.960900    
 H    4.361500      -3.448900       1.262500    
 H    2.850800      -4.340400       1.003300    
 H    1.982200       3.182500      0.6865000    
 H    2.756600      -1.662500      -1.817900    
 H   -1.763200      -3.611300     -0.3584000    
 H   -5.674700      -1.868300     -0.6027000    
 H   -4.207900      -3.856800     -0.6395000    
 H   -1.152300       3.464100      -1.569800    
 H   0.1983000       4.550000      -1.120400    
 H   -1.464600       4.941500     -0.6306000    
 H   -4.660900       1.047400       1.744200    
 H   -6.197300      0.2426000       1.299800    
 H   -5.922300       1.944800      0.8692000    
 H    5.938200       2.116100      0.3429000    
 H    6.235600       1.378300      -1.245000    
 H    6.013400      0.3283000      0.1704000    


%chk=000147386-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000147386

0 1
O -0.548634 -1.499682 -0.224743
O 4.066592 -3.083455 -0.077627
O 3.563544 0.955406 0.303333
O -0.605833 3.413593 0.152061
O -2.831630 1.866482 -0.686643
O -5.142750 0.286502 0.489205
O 4.057838 2.798006 -1.084685
C 1.524659 -0.320810 0.002603
C 2.265610 -1.588796 0.048364
C 0.096658 -0.259533 -0.091965
C 1.692038 -2.961483 0.459819
C -0.669696 0.940211 -0.119285
C 2.154489 0.957272 0.099737
C 2.964266 -3.828231 0.632454
C 0.041564 2.178252 0.006135
C -2.770689 -0.443167 0.022759
C -2.149356 0.873009 -0.269560
C -1.944615 -1.603363 -0.100372
C 3.587316 -1.783409 -0.263154
C 1.441929 2.170772 0.118879
C -4.179639 -0.675377 0.214070
C -2.450486 -2.914428 -0.153650
C -4.700474 -1.990498 0.138073
C -3.845997 -3.092839 -0.059438
C -0.915973 4.143582 -1.100173
C 4.428153 1.932606 -0.272338
C -4.826442 1.506301 1.257362
C 5.822783 1.722347 0.268569
H 1.103300 -2.909222 1.391261
H 1.029230 -3.358284 -0.327525
H 3.277288 -3.920698 1.688426
H 2.903293 -4.824696 0.169264
H 1.959371 3.124159 0.234218
H 4.328473 -1.096372 -0.661241
H -1.761434 -3.754319 -0.271340
H -5.778217 -2.118601 0.269999
H -4.268289 -4.101869 -0.106393
H -1.674716 3.588005 -1.675832
H 0.007656 4.295328 -1.691635
H -1.319308 5.113748 -0.773018
H -4.492145 2.303518 0.576769
H -4.037672 1.304009 2.005995
H -5.770484 1.769311 1.759511
H 5.854871 2.012559 1.334133
H 6.535921 2.338254 -0.297706
H 6.109239 0.658499 0.214922


