%chk=000154829.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154829

0 1
 O   0.1446000      -3.296700      0.4609000    
 C    1.810300      0.2815000     -4.8000002E-03
 C    2.549800     -0.8106000     -0.3033000    
 C   0.3269000      0.2250000     -4.0199999E-02
 C    2.494300       1.564900      0.4148000    
 C    4.061600     -0.8205000     -0.3160000    
 C    3.953700       1.391700      0.8408000    
 C    4.701300      0.5575000     -0.1849000    
 C  -0.2916000     -0.9954000      1.3300000E-02
 C    1.921700      -2.133800     -0.6168000    
 C  -0.5902000       1.396800     -7.7699997E-02
 C   0.5550000      -2.227600      1.3500000E-02
 C   -1.749000      -1.093500      4.2300001E-02
 C   -2.061600       1.287600     -2.0700000E-02
 C   -2.623600      7.9400003E-02  3.9700001E-02
 C  -0.3701000       2.720800     -0.2110000    
 C   -2.585100      -2.149000      6.4700000E-02
 C   -2.654100       2.597300     -8.0799997E-02
 C   -3.998800     -0.3432000      7.5400002E-02
 C   -1.628900       3.453200     -0.1988000    
 C   -3.966200      -1.685400      8.9400001E-02
 H    2.474500       2.263300     -0.4299000    
 H    1.963500       2.023700       1.257000    
 H    4.406500      -1.451300      0.5134000    
 H    4.420800      -1.285300      -1.242100    
 H    4.426800       2.374700      0.9445000    
 H    4.001800      0.9063000       1.823800    
 H    5.753500      0.4533000      0.1023000    
 H    4.685100       1.067200      -1.156600    
 H    1.841300      -2.289700      -1.697100    
 H    2.529400      -2.940800     -0.1901000    
 H   0.5663000       3.239200     -0.3215000    
 H   -2.329100      -3.196000      6.3100003E-02
 H   -3.703500       2.836100     -4.9400002E-02
 H   -4.870300      0.2888000      8.2800001E-02
 H   -1.699900       4.526400     -0.2775000    
 H   -4.820100      -2.343500      0.1128000    


%chk=000154829-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154829

0 1
O -0.049418 -3.467920 -0.103617
C 1.801906 0.304900 -0.010008
C 2.574535 -0.818964 -0.219112
C 0.318345 0.211122 -0.062238
C 2.482811 1.634962 0.324410
C 4.094853 -0.823356 -0.207247
C 3.951443 1.481044 0.773861
C 4.723026 0.583666 -0.211910
C -0.329234 -1.060621 -0.081099
C 1.944390 -2.157910 -0.491267
C -0.541324 1.404735 -0.053024
C 0.459779 -2.300555 -0.187686
C -1.779417 -1.160214 -0.000578
C -2.024690 1.285500 0.014810
C -2.622728 0.051938 0.047320
C -0.291947 2.783563 -0.152334
C -2.649674 -2.251064 0.047132
C -2.611844 2.636014 -0.016253
C -4.045448 -0.365067 0.110925
C -1.563290 3.529546 -0.129796
C -4.049879 -1.744401 0.113357
H 2.456688 2.300393 -0.563834
H 1.911894 2.148395 1.120218
H 4.435090 -1.379337 0.694129
H 4.459384 -1.417963 -1.070218
H 4.419118 2.481054 0.848509
H 3.987791 1.028821 1.785215
H 5.794488 0.523980 0.055508
H 4.663882 1.021053 -1.228486
H 2.061044 -2.396459 -1.573361
H 2.488033 -2.969197 0.030934
H 0.671047 3.276698 -0.259431
H -2.347441 -3.296959 0.044790
H -3.677679 2.861017 0.029309
H -4.902826 0.306623 0.152983
H -1.635944 4.616999 -0.194819
H -4.930163 -2.389635 0.158209


