%chk=000146214.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146214

0 1
 O   0.7917000     -0.3043000       1.231900    
 O    1.421800      -3.249100      -1.627400    
 O    1.135600      -1.845100       2.867000    
 C   0.4055000       1.419600     -0.4671000    
 C  -0.9796000       1.826200      8.2699999E-02
 C    1.484700       2.362800      0.1034000    
 C   -2.119500      0.9458000     -0.4470000    
 C   -3.486100       1.296900      0.1506000    
 C    2.900700       2.172800     -0.4587000    
 C   0.7207000     -1.2900000E-02 -0.1527000    
 C   -4.620400      0.3988000     -0.3482000    
 C    3.914800       3.175300      9.3500003E-02
 C   -5.968400      0.8424000      0.2223000    
 C   0.9231000     -0.9600000      -1.077800    
 C    5.299500       2.941900     -0.4916000    
 C    1.218400      -2.299100     -0.6503000    
 C   -7.105600     -2.1800000E-02 -0.2991000    
 C    1.069900      -1.570200       1.673500    
 C    1.292300      -2.608400      0.6473000    
 C    1.700900      -4.511600      -1.052400    
 H   0.3831000       1.559300      -1.556700    
 H   -1.184500       2.869600     -0.1886000    
 H  -0.9743000       1.785700       1.179900    
 H    1.523600       2.271200       1.197200    
 H    1.179900       3.398300     -9.9699996E-02
 H   -2.167100       1.035700      -1.539200    
 H   -1.920400     -0.1082000     -0.2229000    
 H   -3.428900       1.228900       1.244200    
 H   -3.717800       2.342100     -8.9299999E-02
 H    2.863600       2.260800      -1.551600    
 H    3.250800       1.158200     -0.2340000    
 H   -4.419300     -0.6406000     -6.2700003E-02
 H   -4.656500      0.4325000      -1.443900    
 H    3.964100       3.089600       1.185100    
 H    3.591400       4.196500     -0.1385000    
 H   -5.945300      0.7874000       1.316800    
 H   -6.161500       1.887600     -4.6300001E-02
 H   0.8705000     -0.7453000      -2.139100    
 H    5.288500       3.050200      -1.580900    
 H    5.664100       1.938600     -0.2491000    
 H    6.009700       3.668700     -8.5000001E-02
 H   -7.176500      3.9099999E-02  -1.389800    
 H   -8.059000      0.3117000      0.1225000    
 H   -6.959600      -1.070600     -2.1900000E-02
 H    1.506800      -3.579500       1.074500    
 H    1.849400      -5.207800      -1.886200    
 H   0.8540000      -4.914500     -0.4838000    
 H    2.643900      -4.522600     -0.4922000    


%chk=000146214-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146214

0 1
O 0.856851 -0.316156 1.284070
O 1.543446 -3.290972 -1.568432
O 1.263480 -1.756998 3.060515
C 0.393779 1.374621 -0.380371
C -1.006067 1.734057 0.203565
C 1.481491 2.356138 0.152352
C -2.170926 0.894360 -0.364889
C -3.548111 1.348180 0.170108
C 2.877043 2.167175 -0.481602
C 0.761100 -0.061530 -0.077075
C -4.722640 0.503179 -0.372435
C 3.906428 3.203131 0.025482
C -6.101294 0.965279 0.152832
C 0.990156 -1.055612 -1.002961
C 5.306258 3.012417 -0.597363
C 1.335220 -2.377885 -0.545374
C -7.269513 0.111965 -0.386900
C 1.209258 -1.660311 1.819914
C 1.440581 -2.669374 0.813757
C 1.902236 -4.670256 -1.200332
H 0.348141 1.464356 -1.485238
H -1.192877 2.806758 -0.006752
H -0.969007 1.623381 1.304695
H 1.553129 2.241463 1.251463
H 1.128449 3.389188 -0.042252
H -2.169827 0.959143 -1.473766
H -2.019499 -0.175187 -0.114772
H -3.542872 1.298401 1.278892
H -3.711605 2.414616 -0.092774
H 2.798219 2.241729 -1.587103
H 3.253568 1.147343 -0.263556
H -4.565975 -0.561161 -0.098543
H -4.723077 0.541565 -1.482234
H 3.978263 3.131137 1.129674
H 3.536758 4.225246 -0.196622
H -6.097516 0.930788 1.261422
H -6.258815 2.027888 -0.124129
H 0.914960 -0.854565 -2.072407
H 5.266547 3.106040 -1.699267
H 5.711010 2.010476 -0.360360
H 6.023587 3.764163 -0.219875
H -7.312083 0.152117 -1.491960
H -8.242988 0.463845 0.001700
H -7.152780 -0.948911 -0.095038
H 1.700340 -3.660199 1.190388
H 2.012814 -5.198517 -2.157637
H 1.100869 -5.137552 -0.598571
H 2.856191 -4.692356 -0.641539


