%chk=000160654.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160654

0 1
 O    5.152400      0.9437000      0.7973000    
 O   -5.446600     -0.3081000      -1.155800    
 O   -4.518500       2.538400     -0.9558000    
 C    2.106200     -0.7313000     -0.3450000    
 C    2.783700      0.2949000      0.5892000    
 C   0.7172000      -1.162000      0.1427000    
 C  -0.2001000      9.7199999E-02  0.2422000    
 C   -1.671700     -0.2510000      0.6936000    
 C    1.900100       1.554700      0.6329000    
 C   0.4607000       1.230300       1.073900    
 C    4.175900      0.4294000     -9.8600000E-02
 C    3.177800      -1.802400     -0.5358000    
 C   9.0999998E-02  -2.197200     -0.8012000    
 C    4.514400      -1.033800     -0.4873000    
 C   -2.207900      -1.402100     -0.1651000    
 C   -1.302100      -2.598800     -0.3341000    
 C    2.975500     -0.2219000       2.046100    
 C   -2.556800       1.017100      0.5018000    
 C   -1.732100     -0.6839000       2.176500    
 C   -4.058600      0.7267000      0.5321000    
 C   -3.418000      -1.405100     -0.7483000    
 C    4.157800       1.283000      -1.303000    
 C   -4.388500     -0.3064000     -0.5296000    
 C   -4.855500       2.011400      0.3138000    
 C    4.143500       1.977300      -2.282200    
 H    1.956000     -0.2670000      -1.332900    
 H   0.8114000      -1.630500       1.128200    
 H  -0.2759000      0.4927000     -0.7840000    
 H    1.838700       2.026000     -0.3548000    
 H    2.331400       2.304400       1.307200    
 H   0.4602000      0.9735000       2.137500    
 H  -0.1260000       2.151200      0.9824000    
 H    3.059800      -2.329000      -1.488600    
 H    3.142700      -2.552500      0.2624000    
 H   0.7182000      -3.095100     -0.8474000    
 H   3.6899999E-02  -1.794700      -1.821100    
 H    5.181800      -1.498700      0.2486000    
 H    5.026900      -1.098200      -1.454900    
 H   -1.230400      -3.130000      0.6229000    
 H   -1.718800      -3.316300      -1.051700    
 H    3.633900      -1.094800       2.098200    
 H    3.421700      0.5565000       2.676000    
 H    2.036200     -0.5108000       2.524100    
 H   -2.298500       1.481600     -0.4602000    
 H   -2.325000       1.759900       1.275400    
 H   -1.017300      -1.480000       2.406500    
 H   -1.518200      0.1528000       2.849900    
 H   -2.724500      -1.063700       2.445500    
 H   -4.348600      0.3055000       1.501600    
 H   -3.753100      -2.232200      -1.365600    
 H    4.851100       1.817600       1.100400    
 H   -4.617000       2.754900       1.081300    
 H   -5.933100       1.818100      0.3372000    
 H    4.129900       2.593100      -3.150700    
 H   -5.032500       3.355400      -1.072900    


%chk=000160654-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000160654

0 1
O 5.280519 0.928271 0.782810
O -5.444534 -0.042764 -1.331593
O -4.767600 2.712164 -0.959861
C 2.109384 -0.743732 -0.314749
C 2.789827 0.292851 0.629744
C 0.709493 -1.178814 0.165035
C -0.198110 0.089024 0.274482
C -1.688215 -0.232380 0.714623
C 1.901444 1.556285 0.691516
C 0.456430 1.203470 1.141184
C 4.193322 0.436763 -0.097743
C 3.198297 -1.829346 -0.536415
C 0.079033 -2.207516 -0.799201
C 4.549708 -1.044988 -0.473503
C -2.235760 -1.355887 -0.182882
C -1.360583 -2.579757 -0.368658
C 3.044164 -0.258372 2.056912
C -2.545887 1.062006 0.549786
C -1.759276 -0.725284 2.197114
C -4.072887 0.816729 0.518871
C -3.463586 -1.285490 -0.793237
C 4.120597 1.301390 -1.296188
C -4.403492 -0.172768 -0.605161
C -4.896873 2.118747 0.374452
C 4.106893 2.043052 -2.281655
H 1.960561 -0.225320 -1.289358
H 0.805388 -1.655393 1.163837
H -0.275139 0.491004 -0.762668
H 1.863756 2.028431 -0.310004
H 2.324896 2.306635 1.389943
H 0.468139 0.896662 2.204246
H -0.157094 2.121656 1.087810
H 3.069080 -2.348872 -1.501441
H 3.149355 -2.597959 0.258313
H 0.697614 -3.124046 -0.840350
H 0.058747 -1.783097 -1.824161
H 5.217209 -1.429781 0.316810
H 5.104766 -1.087330 -1.424457
H -1.303008 -3.129317 0.595258
H -1.822384 -3.269039 -1.098828
H 3.638104 -1.188010 2.049000
H 3.610733 0.478913 2.650902
H 2.097325 -0.469949 2.582005
H -2.267460 1.577178 -0.391317
H -2.318523 1.759023 1.378077
H -1.096391 -1.588841 2.380107
H -1.464956 0.080909 2.891477
H -2.787028 -1.035298 2.459114
H -4.378448 0.332900 1.473146
H -3.795044 -2.083308 -1.470441
H 5.235075 1.918438 0.821148
H -4.516960 2.883777 1.073923
H -5.961202 1.914351 0.608948
H 4.093489 2.681390 -3.146009
H -5.235208 2.090439 -1.579915


