%chk=000148888.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148888

0 1
 S    2.046500       1.811100     -0.1409000    
 S   -3.430900      0.4035000     -4.1000001E-02
 O    1.190900      0.6295000      0.5875000    
 O   -2.020700     -0.4193000     -0.1298000    
 O    3.412900       1.355600     -0.3212000    
 O    1.270800       2.251100      -1.286400    
 O   -4.395200     -0.4071000      0.6802000    
 O   -3.118800       1.743700      0.4216000    
 N    2.056400       3.089200       1.001900    
 N   -3.947900      0.5236000      -1.671300    
 C   0.9796000     -0.6098000     -9.5200002E-02
 C  -1.2200000E-02  -1.484900      0.7188000    
 C    2.352000      -1.259100     -0.4042000    
 C   -1.296000     -0.7075000       1.058700    
 C  -0.3956000      -2.787400      9.3999999E-03
 C    2.171200      -2.527600      -1.250400    
 C    3.137000      -1.604500      0.8625000    
 H   0.4987000     -0.3683000      -1.053000    
 H   0.4449000      -1.731100       1.685300    
 H    2.953800     -0.6132000      -1.040800    
 H   -1.064900      0.2269000       1.581500    
 H   -1.930000      -1.306300       1.723400    
 H   -1.346100      -3.167300      0.4063000    
 H  -0.5467000      -2.656600      -1.065300    
 H   0.3125000      -3.589800      0.2153000    
 H    2.037800      -3.436700     -0.6640000    
 H    3.104300      -2.704300      -1.803500    
 H    1.396900      -2.420500      -2.014300    
 H    2.639300      -2.378100       1.455800    
 H    3.279400     -0.7279000       1.501600    
 H    4.130600      -1.984800      0.5999000    
 H    1.155200       3.548200       1.186500    
 H    2.600400       2.934300       1.860400    
 H   -3.382800       1.118700      -2.290600    
 H   -4.239700     -0.3504000      -2.127100    


%chk=000148888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148888

0 1
S 1.207848 1.884104 -0.495389
S -2.867091 0.964138 0.053216
O 1.082690 0.414714 0.649226
O -1.969678 -0.688762 0.110424
O 2.741254 2.288036 -0.757740
O 0.225758 1.565377 -1.752204
O -4.444281 0.745991 0.251400
O -2.039615 1.967633 1.030337
N 0.462574 3.105150 0.486133
N -2.564379 1.443255 -1.584183
C 0.933740 -0.918920 -0.031929
C 0.069940 -1.733434 0.975144
C 2.351407 -1.443025 -0.402477
C -1.217413 -0.963593 1.361932
C -0.277642 -3.144741 0.441516
C 2.338134 -2.453008 -1.577262
C 3.144894 -1.965958 0.815736
H 0.339412 -0.764121 -0.954847
H 0.642759 -1.838040 1.918929
H 2.886203 -0.543789 -0.775148
H -0.963640 -0.008348 1.854944
H -1.851944 -1.581516 2.024237
H -0.978421 -3.641715 1.137139
H -0.768027 -3.088072 -0.546034
H 0.615539 -3.784277 0.356530
H 1.889561 -3.422332 -1.301279
H 3.373636 -2.649406 -1.910220
H 1.779260 -2.052246 -2.443535
H 2.726140 -2.912536 1.206314
H 3.149766 -1.222183 1.633055
H 4.194670 -2.162307 0.532133
H -0.510487 2.855937 0.772071
H 1.104251 3.555381 1.146402
H -1.546151 1.540796 -1.801006
H -3.217069 1.044717 -2.265966


