%chk=000178319.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178319

0 1
 O   -2.083600     -0.7594000      0.3318000    
 C   0.9704000      0.6548000      0.7819000    
 C  -0.3044000       1.018700      1.6600000E-02
 C    1.859500     -0.6482000      0.5322000    
 C    2.290700      0.7062000      3.4000002E-02
 C  -0.4393000     -4.7800001E-02 -0.9903000    
 C   -1.821100      0.7233000      0.4021000    
 C  -0.7807000      -1.212700      6.3500002E-02
 C    1.546000      -1.851600     -0.4395000    
 C   -1.636500      0.3945000      -1.881000    
 C   -2.533400       1.135700     -0.8903000    
 C   1.6100001E-02  -2.332500     -0.5554000    
 C    3.429400       1.341200      0.7707000    
 C    2.364400       1.010500      -1.424100    
 C   -2.381900       1.379700       1.640400    
 C  -0.4958000      -1.512400       1.607400    
 H   0.9549000       1.068700       1.784800    
 H  -0.2052000       2.039500     -0.3714000    
 H    2.386500      -1.026500       1.406900    
 H   0.3720000     -0.2423000      -1.679500    
 H    2.112300      -2.712000     -5.7300001E-02
 H    1.953800      -1.696500      -1.440800    
 H   -2.136000     -0.4670000      -2.336400    
 H   -1.311000       1.071900      -2.678000    
 H   -2.511100       2.218200      -1.055000    
 H   -3.567400      0.7812000     -0.9529000    
 H  -0.2500000      -2.519800      -1.602900    
 H  -0.1272000      -3.294900     -4.8400000E-02
 H    3.417500       2.428800      0.6384000    
 H    4.389300      0.9597000      0.4052000    
 H    3.390300       1.144300       1.848400    
 H    3.291400       1.551300      -1.658200    
 H    1.566900       1.680200      -1.758500    
 H    2.399600      0.1381000      -2.076600    
 H   -1.854900       1.059300       2.542700    
 H   -2.308200       2.469900       1.578300    
 H   -3.433700       1.108300       1.780000    
 H   0.4373000      -2.029500       1.847500    
 H  -0.5752000     -0.6475000       2.269500    
 H   -1.273100      -2.206300       1.966800    


%chk=000178319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178319

0 1
O -2.213567 -0.759798 0.345795
C 1.007874 0.695205 0.786638
C -0.317516 1.016093 0.055215
C 1.824564 -0.627193 0.460299
C 2.354514 0.763909 -0.002396
C -0.426828 -0.084058 -0.971292
C -1.911028 0.779869 0.426889
C -0.776191 -1.248639 0.083709
C 1.473671 -1.901903 -0.433055
C -1.638781 0.287587 -1.879561
C -2.519673 1.180000 -0.940834
C -0.060935 -2.444533 -0.570799
C 3.558116 1.290366 0.790104
C 2.414934 1.170445 -1.485772
C -2.515739 1.370418 1.687807
C -0.438205 -1.460996 1.615367
H 1.091947 1.021978 1.833062
H -0.280661 2.052652 -0.339154
H 2.368175 -0.960797 1.355997
H 0.459216 -0.283698 -1.574250
H 2.072791 -2.730254 -0.010312
H 1.864038 -1.737441 -1.456201
H -2.188607 -0.600274 -2.232146
H -1.276108 0.844212 -2.764738
H -2.419066 2.260983 -1.157816
H -3.587363 0.907938 -0.975616
H -0.302025 -2.598987 -1.637960
H -0.182158 -3.401575 -0.033019
H 3.598095 2.396613 0.758788
H 4.507591 0.904707 0.369817
H 3.511523 0.985462 1.852090
H 3.248536 1.877981 -1.645051
H 1.494354 1.670283 -1.834711
H 2.598740 0.302756 -2.148771
H -2.044272 0.963568 2.598446
H -2.386395 2.469584 1.691495
H -3.596962 1.150581 1.737484
H 0.523702 -1.947042 1.834349
H -0.526294 -0.551913 2.224800
H -1.245408 -2.146988 1.937900


