%chk=000065944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065944

0 1
 S   -3.036500       2.053700     -0.2523000    
 O   0.6282000     -0.9981000       1.044400    
 O    4.593300     -0.5297000      0.6979000    
 O   -2.942500      -2.354800      0.2213000    
 O   -2.235300      -1.075700      -1.527900    
 N  -0.9342000      0.5265000      0.2579000    
 N    2.609000      0.7128000      0.7305000    
 C    1.465400      0.9021000     -0.1162000    
 C   -2.094500     -0.2211000      0.7325000    
 C    1.938700      0.4230000      -1.475400    
 C   0.3585000      4.8400000E-02  0.4516000    
 C    3.025900     -0.6029000      -1.156400    
 C   -3.245500      0.7412000      0.9773000    
 C   -1.263400       1.763300     -0.4419000    
 C    3.549500     -0.1553000      0.1864000    
 C   -2.416600      -1.233600     -0.3298000    
 H    1.236500       1.967300     -0.1100000    
 H   -1.823200     -0.7582000       1.649200    
 H    2.387100       1.259600      -2.025900    
 H    1.143700      5.0000002E-04  -2.097700    
 H    3.819700     -0.5987000      -1.907300    
 H    2.610100      -1.610200      -1.056100    
 H   -4.229200      0.2719000      0.8860000    
 H   -3.162100       1.195500       1.969700    
 H  -0.7244000       2.600700      7.3000002E-03
 H  -0.9895000       1.670700      -1.496600    
 H    2.707900       1.134000       1.649000    
 H   -3.161100      -3.028600     -0.4572000    


%chk=000065944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065944

0 1
S -2.995095 2.092769 -0.158436
O 0.596448 -0.701676 1.583570
O 4.796361 -0.474276 0.619857
O -3.634503 -2.015732 0.045431
O -1.947144 -1.551099 -1.485608
N -0.881453 0.434964 0.199953
N 2.811013 0.788313 0.798440
C 1.554935 1.016408 0.090444
C -2.023630 -0.346453 0.692805
C 1.900897 0.567077 -1.378902
C 0.399446 0.181822 0.698949
C 3.072933 -0.428556 -1.206014
C -3.120722 0.667850 1.099884
C -1.281675 1.456003 -0.767296
C 3.700525 -0.072762 0.153228
C -2.494279 -1.336465 -0.385590
H 1.279121 2.088141 0.117747
H -1.680051 -0.936673 1.563681
H 2.228312 1.449179 -1.955767
H 1.030496 0.122760 -1.888491
H 3.829435 -0.364193 -2.003665
H 2.727027 -1.476981 -1.153581
H -4.126600 0.229649 1.045166
H -2.923245 1.068672 2.104858
H -0.580077 2.300051 -0.798048
H -1.431641 1.027132 -1.770883
H 2.924194 0.995693 1.791619
H -3.915529 -2.677318 -0.643048


