%chk=000166956.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166956

0 1
 O   -5.377900      0.2973000      0.5283000    
 O    5.158800     -0.9654000      0.3578000    
 O    4.609000      -3.091500     -0.2175000    
 C   -4.059000      0.8565000      0.4805000    
 C   -4.334700     -0.5470000      2.4599999E-02
 C   -3.908100       1.944500     -0.5127000    
 C   -4.010500      -1.705400      0.9175000    
 C   -2.494200       2.057100      -1.104600    
 C   -2.548800      -2.149900      0.8248000    
 C   -1.427000       2.351700     -4.6799999E-02
 C   -2.127200      -2.523800     -0.5994000    
 C  -4.0700000E-02   2.486100     -0.6810000    
 C  -0.6666000      -2.976800     -0.7010000    
 C    1.033000       2.747500      0.3777000    
 C   0.3790000      -1.968800     -0.2127000    
 C    2.422500       2.849000     -0.2556000    
 C    1.814700      -2.499900     -0.2821000    
 C    3.538400       3.080200      0.7655000    
 C    2.845500      -1.445300      0.1246000    
 C    4.924100       3.155600      0.1433000    
 C    4.269900      -1.951800      6.8800002E-02
 H   -3.560100       1.034600       1.422100    
 H   -4.360400     -0.7856000      -1.028800    
 H   -4.613500       1.808600      -1.342600    
 H   -4.175200       2.896100     -3.7400000E-02
 H   -4.235400      -1.459800       1.963000    
 H   -4.662700      -2.544800      0.6481000    
 H   -2.492100       2.853800      -1.858100    
 H   -2.243800       1.122800      -1.622300    
 H   -1.926000      -1.327900       1.194100    
 H   -2.389800      -3.003900       1.493500    
 H   -1.399000       1.544300      0.6938000    
 H   -1.680900       3.275500      0.4864000    
 H   -2.256800      -1.666200      -1.269100    
 H   -2.774600      -3.325100     -0.9751000    
 H   0.2015000       1.567800      -1.229700    
 H  -4.6700001E-02   3.306100      -1.409400    
 H  -0.5519000      -3.907500     -0.1309000    
 H  -0.4552000      -3.228800      -1.747700    
 H   0.8053000       3.675400      0.9157000    
 H    1.028000       1.935200       1.114800    
 H   0.2967000      -1.054100     -0.8122000    
 H   0.1773000      -1.688300      0.8265000    
 H    2.428700       3.668500     -0.9850000    
 H    2.634400       1.928900     -0.8137000    
 H    1.910600      -3.379400      0.3667000    
 H    2.029200      -2.840700      -1.302700    
 H    3.527700       2.269100       1.503500    
 H    3.343400       4.010400       1.312100    
 H    2.768200     -0.5850000     -0.5493000    
 H    2.647300      -1.110400       1.148900    
 H    5.680200       3.321000      0.9170000    
 H    5.168000       2.225100     -0.3789000    
 H    4.984600       3.979100     -0.5753000    
 H    6.085500      -1.283800      0.3130000    


%chk=000166956-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166956

0 1
O -5.627589 0.346085 0.442073
O 5.217004 -0.709039 -0.245473
O 4.729401 -2.977833 -0.303712
C -4.221031 0.916248 0.368871
C -4.453013 -0.526082 0.032989
C -3.968082 1.965062 -0.700517
C -4.071102 -1.640095 0.993697
C -2.497851 1.983307 -1.195426
C -2.564755 -2.004632 0.926060
C -1.452358 2.279524 -0.094529
C -2.110073 -2.571215 -0.440739
C -0.017848 2.419525 -0.651987
C -0.641742 -3.061869 -0.456777
C 1.047966 2.640977 0.444706
C 0.404191 -1.937730 -0.270544
C 2.482816 2.784390 -0.110913
C 1.856321 -2.453531 -0.373285
C 3.550463 2.984494 0.988886
C 2.885348 -1.317632 -0.220858
C 4.987468 3.041875 0.426878
C 4.322576 -1.796976 -0.263493
H -3.812749 1.127477 1.368480
H -4.487690 -0.786530 -1.035215
H -4.646764 1.760164 -1.550581
H -4.241587 2.963914 -0.305995
H -4.330229 -1.310090 2.018027
H -4.684674 -2.538272 0.781449
H -2.404533 2.747829 -1.993151
H -2.259826 1.007571 -1.667972
H -1.969185 -1.104416 1.178622
H -2.346205 -2.756873 1.711354
H -1.465358 1.468811 0.662852
H -1.732286 3.211816 0.439466
H -2.240242 -1.802228 -1.229894
H -2.776041 -3.415814 -0.713272
H 0.238817 1.506757 -1.231280
H 0.014830 3.262615 -1.373380
H -0.502844 -3.825884 0.336718
H -0.442257 -3.574467 -1.420137
H 0.788897 3.547213 1.031322
H 1.016695 1.791238 1.159794
H 0.232256 -1.153126 -1.038666
H 0.260233 -1.447371 0.713814
H 2.520990 3.638900 -0.818488
H 2.740866 1.881903 -0.703832
H 2.039371 -3.222917 0.401018
H 2.007105 -2.958957 -1.346881
H 3.477241 2.154234 1.721430
H 3.326267 3.915117 1.549580
H 2.756909 -0.551594 -1.010303
H 2.740385 -0.779694 0.738145
H 5.728689 3.214848 1.229130
H 5.244088 2.090461 -0.074923
H 5.092840 3.859398 -0.311622
H 6.150581 -1.055986 -0.260512


