%chk=000091682.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091682

0 1
 O  -1.4900000E-02   2.513300     -0.6233000    
 O   -2.473700       2.038100      0.4794000    
 C    5.438900     -0.7272000      0.3691000    
 C    4.059800     -0.1982000      0.1624000    
 C    6.147400      -1.058600     -0.9579000    
 C    5.465200      -1.956900       1.296600    
 C    3.091400     -0.9949000     -0.4482000    
 C    3.739000       1.094200      0.5780000    
 C    1.515100      0.7800000     -0.2224000    
 C    1.802200     -0.4993000     -0.6432000    
 C    2.449800       1.589700      0.3832000    
 C   0.1369000       1.309900     -0.4289000    
 C   -1.025800      0.3316000     -0.4231000    
 C   -2.382500      0.8661000      6.4199999E-02
 C   -3.543900     -8.8000000E-03  6.6399999E-02
 C   -3.424900      -1.327400     -0.3724000    
 C   -4.777200      0.4707000      0.5077000    
 C   -4.539100      -2.166500     -0.3698000    
 C   -5.891400     -0.3685000      0.5105000    
 C   -5.772400      -1.687200      7.1800001E-02
 H    6.045300      4.5899998E-02  0.8606000    
 H    5.657000      -1.880900      -1.490000    
 H    7.186600      -1.352800     -0.7749000    
 H    6.156600     -0.1872000      -1.622200    
 H    4.983600      -1.731700       2.254700    
 H    6.497500      -2.260400       1.502200    
 H    4.947400      -2.814700      0.8542000    
 H    3.320500      -2.002700     -0.7834000    
 H    4.481200       1.727900       1.056300    
 H    1.072100      -1.132800      -1.136500    
 H    2.212000       2.595300      0.7164000    
 H  -0.7687000     -0.5004000      0.2426000    
 H   -1.142300     -2.0600000E-02  -1.454100    
 H   -2.486800      -1.745300     -0.7235000    
 H   -4.896800       1.493800      0.8542000    
 H   -4.447100      -3.193600     -0.7111000    
 H   -6.851800      4.6000001E-03  0.8540000    
 H   -6.639900      -2.340600      7.3899999E-02


%chk=000091682-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091682

0 1
O 0.050593 2.824954 -1.365553
O -1.289903 0.750651 1.236700
C 5.289908 -0.727232 0.524358
C 3.937962 -0.142301 0.112361
C 5.744030 -1.854423 -0.441718
C 5.264725 -1.232548 1.992440
C 2.770395 -0.950531 0.063257
C 3.814038 1.231515 -0.226852
C 1.411033 0.965044 -0.658362
C 1.527519 -0.409293 -0.315944
C 2.574710 1.778706 -0.605029
C 0.122187 1.593101 -1.079326
C -1.141565 0.730486 -1.206525
C -1.814777 0.404436 0.140833
C -3.124763 -0.333319 0.108474
C -3.744675 -0.745390 -1.102408
C -3.760437 -0.625427 1.346948
C -4.974341 -1.436928 -1.074139
C -4.988208 -1.314681 1.373879
C -5.598651 -1.722572 0.162553
H 6.038128 0.088530 0.463465
H 5.043701 -2.709856 -0.414234
H 6.743966 -2.228455 -0.154012
H 5.795510 -1.492168 -1.484149
H 4.970424 -0.426649 2.688136
H 6.263556 -1.601962 2.290040
H 4.546375 -2.064174 2.115279
H 2.833884 -2.012441 0.328224
H 4.703149 1.872968 -0.190713
H 0.646381 -1.059638 -0.327025
H 2.474446 2.837805 -0.864850
H -0.926627 -0.217145 -1.738380
H -1.857352 1.299815 -1.827856
H -3.276481 -0.528256 -2.068182
H -3.268732 -0.296656 2.268569
H -5.447088 -1.750202 -2.011226
H -5.472161 -1.534059 2.331738
H -6.554557 -2.257809 0.182730


