%chk=000169494.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169494

0 1
 O   -3.869200       1.137200     -0.9706000    
 O   -1.350000      -2.086300     -6.4599998E-02
 O    2.925100     -0.1500000     -0.3690000    
 O  -0.5846000      -4.247600      0.1735000    
 O    3.951200       1.485800      0.8989000    
 C   -3.056800      0.1909000     -0.2578000    
 C   -1.564100      0.3235000     -0.4987000    
 C   -3.568200       1.418600      0.4002000    
 C   -2.430900       2.362700      0.6282000    
 C   -1.183900       1.698000      6.4599998E-02
 C  -0.7724000     -0.7901000      0.1978000    
 C   0.6626000     -0.9404000     -0.2991000    
 C   -3.764100      -1.098700     -8.6900003E-02
 C   5.3700000E-02   2.228700      9.5200002E-02
 C    1.619800      0.1779000      0.1214000    
 C    1.251100       1.532800     -0.5026000    
 C   0.9006000      -2.332200      0.2004000    
 C  -0.3954000      -3.046800      0.1192000    
 C   0.3524000       3.578600      0.6941000    
 C    1.982600      -2.932100      0.7017000    
 C    3.902000      0.7559000     -8.1699997E-02
 C    4.938200      0.7336000      -1.164300    
 H   -1.401100      0.2961000      -1.583400    
 H   -4.351800       1.399400       1.138300    
 H   -2.313500       2.534100       1.703600    
 H   -2.630600       3.315400      0.1269000    
 H  -0.8124000     -0.6425000       1.288400    
 H   0.6743000      -1.015400      -1.397400    
 H   -3.498000      -1.584400      0.8570000    
 H   -4.851200     -0.9522000     -5.1300000E-02
 H   -3.576500      -1.773200     -0.9281000    
 H    1.661200      0.2454000       1.216800    
 H    1.074200       1.396300      -1.579700    
 H    2.085000       2.242100     -0.4845000    
 H  -0.5236000       4.063900       1.132200    
 H   0.7498000       4.251700     -7.2899997E-02
 H    1.099700       3.478000       1.488600    
 H    2.929700      -2.414700      0.7948000    
 H    1.954300      -3.962600       1.040600    
 H    4.482100       1.007200      -2.119100    
 H    5.391200     -0.2592000      -1.223600    
 H    5.721400       1.460800     -0.9315000    


%chk=000169494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169494

0 1
O -3.871552 1.326444 -0.981551
O -1.296875 -2.115830 0.251819
O 2.896820 0.000648 -0.674971
O -0.365469 -4.228907 0.591841
O 3.957981 1.537660 0.727817
C -3.197135 0.179138 -0.217666
C -1.670000 0.311224 -0.420872
C -3.684575 1.391578 0.522294
C -2.526003 2.296825 0.895954
C -1.328177 1.715080 0.136269
C -0.767492 -0.706115 0.311434
C 0.667012 -0.854815 -0.292042
C -3.953553 -1.125909 -0.280969
C -0.104007 2.302905 0.033319
C 1.577504 0.353580 -0.042887
C 1.046143 1.641465 -0.724758
C 1.069998 -2.225016 0.235857
C -0.200757 -3.013655 0.395368
C 0.229490 3.641107 0.665450
C 2.279097 -2.769336 0.513834
C 4.018325 0.699979 -0.200486
C 5.256396 0.309508 -0.975771
H -1.465405 0.246510 -1.509511
H -4.617678 1.392908 1.096318
H -2.364801 2.284404 1.994009
H -2.734754 3.343130 0.605894
H -0.709160 -0.448669 1.387446
H 0.539173 -0.950086 -1.393087
H -3.694575 -1.783445 0.564575
H -5.037163 -0.917420 -0.266268
H -3.716499 -1.678938 -1.206238
H 1.754945 0.532616 1.034407
H 0.745438 1.385292 -1.760493
H 1.883514 2.356736 -0.792637
H -0.601402 4.056645 1.257900
H 0.500404 4.384218 -0.110878
H 1.112162 3.548954 1.328701
H 3.210970 -2.216956 0.373545
H 2.331009 -3.800256 0.883773
H 5.341805 0.949638 -1.873221
H 5.202996 -0.736932 -1.314392
H 6.149751 0.470294 -0.353524


