%chk=000156460.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156460

0 1
 O  -0.2225000       2.235100      0.1185000    
 O   -3.749500      -1.111900       2.129700    
 O   -2.702200      -2.024500      -1.243000    
 O  -0.2131000      -2.547800     -0.8148000    
 C   -3.957900      -1.325200      0.7278000    
 C   -2.428700       1.059300      7.4299999E-02
 C   -2.569900      -1.454800      6.1700001E-02
 C   -1.821900     -0.1390000     -5.9599999E-02
 C   -4.709600     -0.1256000      0.1445000    
 C   -3.920000       1.172000      0.3280000    
 C   -1.649100       2.369700     -5.2200001E-02
 C  -0.3692000     -0.1474000     -0.3296000    
 C   -4.788900      -2.603800      0.5802000    
 C   0.3506000       1.046100     -0.2257000    
 C   -1.874300       2.997700      -1.437800    
 C   -2.053100       3.383400       1.032300    
 C   0.3433000      -1.312000     -0.6626000    
 C    1.735400       1.079200     -0.4272000    
 C    2.421500     -8.3899997E-02 -0.7597000    
 C    1.724300      -1.279900     -0.8796000    
 C    3.894700     -4.7499999E-02 -0.9835000    
 C    4.737300     -0.2926000      0.2821000    
 C    6.243100     -0.1819000      2.3600001E-02
 C    7.043100     -0.4058000       1.307400    
 C    8.536900     -0.2590000       1.065300    
 H   -1.984900      -2.137500      0.6918000    
 H   -5.685900     -6.3999998E-03  0.6311000    
 H   -4.901700     -0.2863000     -0.9243000    
 H   -4.069200       1.524200       1.356500    
 H   -4.360200       1.926800     -0.3333000    
 H   -5.055700      -2.807800     -0.4616000    
 H   -4.244600      -3.467500      0.9786000    
 H   -5.717900      -2.531600       1.157800    
 H   -1.268500       3.903900      -1.556600    
 H   -1.563200       2.313900      -2.236500    
 H   -2.922500       3.264000      -1.607400    
 H   -1.415000       4.274700      0.9893000    
 H   -3.092300       3.713300      0.9335000    
 H   -1.917300       2.956800       2.033300    
 H   -4.619000     -0.9833000       2.545900    
 H   -2.835800      -2.981200      -1.133600    
 H    2.271700       2.020000     -0.3242000    
 H    2.265300      -2.187800      -1.138100    
 H    4.167200     -0.7881000      -1.747200    
 H    4.169400      0.9234000      -1.417300    
 H    4.506700      -1.286900      0.6853000    
 H    4.448600      0.4320000       1.054300    
 H   0.4659000      -3.204000      -1.044900    
 H    6.540900     -0.9188000     -0.7320000    
 H    6.471000      0.8104000     -0.3840000    
 H    6.837900      -1.406900       1.703800    
 H    6.731800      0.3161000       2.071400    
 H    8.778600      0.7443000      0.7003000    
 H    9.089600     -0.4244000       1.995400    
 H    8.887800     -0.9873000      0.3272000    


%chk=000156460-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156460

0 1
O -0.320467 2.219823 0.222514
O -3.362285 -1.086861 2.289525
O -3.012164 -2.026478 -1.249937
O -0.362917 -2.381757 -1.435294
C -3.866738 -1.373246 0.916339
C -2.517934 1.054050 0.099226
C -2.587147 -1.474125 0.053092
C -1.871308 -0.133906 -0.134964
C -4.723557 -0.197075 0.407548
C -3.963472 1.135050 0.548961
C -1.783990 2.382446 -0.115412
C -0.436880 -0.116093 -0.517807
C -4.644855 -2.698271 0.921642
C 0.313688 1.076477 -0.266535
C -1.885536 2.828924 -1.594391
C -2.216922 3.503039 0.844991
C 0.321865 -1.194266 -1.052858
C 1.710563 1.158544 -0.430761
C 2.436993 0.047315 -0.914410
C 1.718373 -1.126139 -1.247258
C 3.949117 0.105034 -1.059502
C 4.692638 -0.233557 0.263704
C 6.229041 -0.169113 0.118208
C 6.977834 -0.510613 1.427024
C 8.513228 -0.446823 1.276002
H -1.901450 -2.184608 0.556560
H -5.681957 -0.150598 0.961651
H -4.956337 -0.393538 -0.655838
H -3.979394 1.457002 1.610292
H -4.493700 1.924801 -0.021507
H -4.961241 -2.965964 -0.098878
H -4.010640 -3.514184 1.312651
H -5.544359 -2.614161 1.564252
H -1.337065 3.775487 -1.747655
H -1.465201 2.058136 -2.263353
H -2.943374 2.983742 -1.874870
H -1.567467 4.381367 0.689587
H -3.261797 3.805618 0.662992
H -2.114068 3.176834 1.893572
H -4.123776 -1.182809 2.916669
H -2.164857 -2.315042 -1.690742
H 2.209942 2.102402 -0.190951
H 2.253443 -1.987756 -1.670211
H 4.283593 -0.601080 -1.845282
H 4.258012 1.117341 -1.386904
H 4.390719 -1.245440 0.601706
H 4.361779 0.469151 1.054440
H 0.279550 -3.075300 -1.721201
H 6.553685 -0.867880 -0.681694
H 6.525118 0.846649 -0.218814
H 6.679204 -1.524573 1.763005
H 6.653567 0.188191 2.224811
H 8.840027 0.565911 0.973057
H 9.024476 -0.697226 2.223726
H 8.865398 -1.156951 0.503883


