%chk=000167992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167992

0 1
 O    4.986300       2.187100      0.5359000    
 O   0.7808000       4.203400     -2.8700000E-02
 O    4.849200      -2.923400      1.6600000E-02
 O   -8.461500      0.5118000     -0.3983000    
 C    1.436400       1.884900     -0.3255000    
 C    2.771700       1.288000      0.1446000    
 C    3.805000       2.358600     -0.2308000    
 C   0.2354000       1.345000      0.4308000    
 C    3.128400       3.682500      0.1174000    
 C    1.668300       3.360300     -6.9899999E-02
 C   -1.073300       1.654900     -0.2984000    
 C    3.058200     -4.1299999E-02 -0.4772000    
 C   -2.275800       1.074700      0.4491000    
 C    3.262200      -1.165500      0.2249000    
 C   -3.607300       1.294000     -0.2749000    
 C    3.551400      -2.499300     -0.4046000    
 C   -4.799700      0.6499000      0.4358000    
 C    2.553200      -3.586900      1.5500000E-02
 C    1.097600      -3.220900     -0.2892000    
 C   -6.096000      0.8795000     -0.3402000    
 C   9.2600003E-02  -4.268900      0.2001000    
 C   -7.295200      0.2781000      0.3790000    
 C   -1.355800      -3.941100     -0.1646000    
 C   -2.312000      -5.005500      0.3527000    
 H    1.320600       1.752700      -1.409200    
 H    2.764300       1.183400       1.240200    
 H    4.061800       2.318600      -1.296700    
 H   0.3216000      0.2571000      0.5377000    
 H   0.1981000       1.763500       1.444500    
 H    3.311100       3.980800       1.153900    
 H    3.440900       4.478500     -0.5630000    
 H   -1.212400       2.735000     -0.4102000    
 H   -1.038100       1.229200      -1.308800    
 H    3.098100     -8.2599998E-02  -1.563400    
 H   -2.124200     -2.7999999E-03  0.5916000    
 H   -2.332500       1.521100       1.449600    
 H    5.579000       2.929000      0.3262000    
 H    3.229000      -1.130300       1.311400    
 H   -3.532100      0.8852000      -1.290400    
 H   -3.784000       2.371600     -0.3800000    
 H    3.566000      -2.428600      -1.498500    
 H   -4.623300     -0.4267000      0.5477000    
 H   -4.892300       1.069800       1.444600    
 H    2.814800      -4.527600     -0.4856000    
 H    2.663200      -3.788800       1.089700    
 H   0.9827000      -3.086200      -1.371800    
 H   0.8385000      -2.264800      0.1790000    
 H   -6.265000       1.953400     -0.4890000    
 H   -6.018400      0.4462000      -1.345200    
 H   0.3581000      -5.244200     -0.2266000    
 H   0.1804000      -4.366100       1.289500    
 H    5.490400      -2.259800     -0.2911000    
 H   -7.172700     -0.8022000      0.5061000    
 H   -7.433100      0.7395000       1.362000    
 H   -1.633800      -2.968700      0.2582000    
 H   -1.455800      -3.862600      -1.253200    
 H   -2.078300      -5.985000     -7.6600000E-02
 H   -2.257300      -5.085400       1.443000    
 H   -3.341900      -4.752800      8.1900001E-02
 H   -9.208800      0.1182000      8.3600000E-02


%chk=000167992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167992

0 1
O 5.248917 2.272795 0.330474
O 0.866724 4.350183 -0.138900
O 4.658184 -3.156170 0.423185
O -8.382299 0.011394 -0.261071
C 1.586805 1.969120 -0.288209
C 2.978691 1.388810 0.131820
C 3.984547 2.447762 -0.392203
C 0.377295 1.402829 0.488501
C 3.287616 3.803233 -0.131584
C 1.781584 3.494563 -0.189501
C -0.981305 1.601526 -0.220987
C 3.206550 -0.010038 -0.378353
C -2.144818 0.914678 0.527597
C 3.277336 -1.122897 0.396849
C -3.505317 1.071003 -0.187279
C 3.433875 -2.528101 -0.137549
C -4.660043 0.339715 0.533904
C 2.277649 -3.463449 0.267375
C 0.927731 -3.089594 -0.382340
C -6.017480 0.507242 -0.185371
C -0.238686 -3.990058 0.082771
C -7.157928 -0.224678 0.526095
C -1.597786 -3.583260 -0.531893
C -2.769196 -4.467094 -0.051993
H 1.436638 1.748608 -1.371400
H 3.049109 1.397311 1.238904
H 4.141318 2.304083 -1.484630
H 0.551073 0.317487 0.639566
H 0.340785 1.863697 1.496206
H 3.526370 4.143103 0.896909
H 3.555899 4.619858 -0.824474
H -1.183258 2.684038 -0.328313
H -0.917454 1.184769 -1.248838
H 3.268388 -0.118172 -1.475141
H -1.916578 -0.167074 0.644150
H -2.218973 1.329117 1.554666
H 5.920536 2.907168 -0.026485
H 3.227988 -1.037794 1.493415
H -3.420983 0.684963 -1.224557
H -3.751090 2.149346 -0.275918
H 3.508182 -2.491850 -1.248060
H -4.411491 -0.740282 0.613971
H -4.738601 0.720068 1.574127
H 2.565586 -4.494174 -0.017788
H 2.187892 -3.450859 1.371790
H 1.017371 -3.149178 -1.487568
H 0.682305 -2.033246 -0.147501
H -6.278610 1.580942 -0.256711
H -5.946458 0.124472 -1.222085
H -0.019584 -5.046964 -0.176104
H -0.312800 -3.950887 1.189768
H 5.407129 -2.513343 0.325351
H -6.932701 -1.312655 0.586978
H -7.273410 0.165817 1.561461
H -1.806308 -2.522262 -0.279093
H -1.526448 -3.629003 -1.637919
H -2.599932 -5.527711 -0.317519
H -2.882812 -4.412060 1.047282
H -3.726756 -4.153933 -0.507740
H -9.146270 -0.445412 0.173162


