%chk=000156510.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156510

0 1
 O    3.866000      -1.103200     -0.3256000    
 O   0.3713000       2.881200      0.5092000    
 O   -2.240200      -2.831900     -2.8899999E-02
 C  -0.4204000     -0.6246000      0.2210000    
 C   0.4292000      0.5772000     -0.3182000    
 C    1.991600      0.5028000     -0.1341000    
 C   0.2228000      -1.957100     -0.2465000    
 C   -1.871400     -0.5034000     -0.4148000    
 C    2.482300     -0.8992000     -0.6107000    
 C    1.716400      -2.052700      2.8400000E-02
 C  -0.5237000     -0.6347000       1.767100    
 C  -0.2361000       1.890100      0.1136000    
 C    2.658800       1.565000      -1.054400    
 C    2.494500      0.7813000       1.300400    
 C   -2.455300      0.9057000     -0.3081000    
 C   -2.850800      -1.568300      0.1163000    
 C   -1.708700       1.986800     -3.5399999E-02
 C   -3.926200       1.084900     -0.5794000    
 H   0.2908000      0.5686000      -1.413400    
 H   5.3100001E-02  -2.110300      -1.319600    
 H  -0.1779000      -2.820000      0.2879000    
 H   -1.761800     -0.6975000      -1.493100    
 H    2.364500     -0.9793000      -1.699700    
 H    1.916200      -2.104700       1.104700    
 H    2.098200      -3.001300     -0.3716000    
 H   0.4475000     -0.6951000       2.254100    
 H   -1.027000      0.2549000       2.157700    
 H   -1.081200      -1.505600       2.127600    
 H    2.356900       1.428700      -2.099000    
 H    2.399300       2.586800     -0.7647000    
 H    3.751900       1.503000      -1.020300    
 H    3.573200      0.9813000       1.303600    
 H    2.016400       1.651700       1.754600    
 H    2.350500     -6.5099999E-02   1.973000    
 H   -3.775600      -1.582000     -0.4696000    
 H   -3.113700      -1.405800       1.166400    
 H   -2.142500       2.977900      4.8200000E-02
 H    4.380600     -0.5239000     -0.9116000    
 H   -4.526200      0.6255000      0.2123000    
 H   -4.193500      0.6301000      -1.538800    
 H   -4.211700       2.141400     -0.6322000    
 H   -2.865400      -3.495300      0.3092000    


%chk=000156510-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156510

0 1
O 3.947015 -1.100242 -0.421568
O 0.416379 2.889121 0.595776
O -2.459477 -2.922529 0.057801
C -0.406773 -0.668471 0.240829
C 0.450278 0.559652 -0.296641
C 2.019123 0.515417 -0.122976
C 0.272654 -1.979647 -0.268335
C -1.857696 -0.559681 -0.395813
C 2.506339 -0.882038 -0.641302
C 1.782487 -2.052593 0.023447
C -0.517636 -0.684037 1.788564
C -0.207323 1.878592 0.144205
C 2.630055 1.611027 -1.050518
C 2.532331 0.768387 1.322302
C -2.443112 0.861789 -0.354074
C -2.912089 -1.529987 0.201081
C -1.665839 1.948499 -0.062618
C -3.915165 1.064575 -0.668102
H 0.284276 0.529946 -1.402286
H 0.123360 -2.050752 -1.367054
H -0.251489 -2.845955 0.163305
H -1.759813 -0.837365 -1.472211
H 2.295461 -0.916093 -1.738488
H 1.990032 -2.055454 1.109452
H 2.194276 -2.997254 -0.377433
H 0.473024 -0.688135 2.266072
H -1.066329 0.194680 2.175058
H -1.042930 -1.597352 2.120579
H 2.298715 1.481237 -2.099961
H 2.338446 2.616390 -0.709046
H 3.738311 1.571140 -1.036622
H 3.627905 0.907975 1.304724
H 2.074173 1.678155 1.740671
H 2.338802 -0.079081 2.000504
H -3.864804 -1.401863 -0.348777
H -3.090974 -1.284477 1.269411
H -2.104250 2.951879 0.007843
H 4.449626 -0.357846 -0.843720
H -4.573293 0.650391 0.120177
H -4.195048 0.564040 -1.615647
H -4.147970 2.137971 -0.766469
H -3.178356 -3.526109 0.373460


