%chk=000041433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041433

0 1
 S    2.215500       1.818900      0.3518000    
 S    2.374200      -1.556800     -0.4365000    
 O   -1.064200      0.1866000     -0.2699000    
 O   -2.592500      -1.378000      0.4545000    
 N  -0.1660000     -0.8803000     -0.1358000    
 N   -3.211700      0.7990000     -4.5600001E-02
 C    3.704200      0.7683000      0.3592000    
 C    3.404600     -0.6680000      0.7699000    
 C    1.261400      0.9408000     -0.9112000    
 C    1.009800     -0.4669000     -0.4691000    
 C   -2.315100     -0.2420000      8.1500001E-02
 C   -4.620200      0.6785000      0.2513000    
 H    4.403000       1.206600       1.079700    
 H    4.188200      0.8146000     -0.6226000    
 H    4.346800      -1.219000      0.8591000    
 H    2.919100     -0.7042000       1.751700    
 H    1.845800      0.9238000      -1.838800    
 H   0.3715000       1.528800      -1.138600    
 H   -2.861800       1.699400     -0.3585000    
 H   -4.887800     -0.3494000      0.5070000    
 H   -5.183100       1.001100     -0.6279000    
 H   -4.849400       1.340500       1.089900    


%chk=000041433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041433

0 1
S 2.542482 1.941087 0.300104
S 2.328534 -1.617192 -0.178737
O -1.217893 0.227475 -0.201957
O -2.861468 -1.482358 0.199508
N -0.187626 -0.809550 0.053940
N -3.391819 0.804856 0.019700
C 3.983609 0.715765 0.228279
C 3.626929 -0.642960 0.829014
C 1.352956 1.000244 -0.850092
C 0.993413 -0.350714 -0.297558
C -2.555466 -0.288663 0.039547
C -4.844763 0.666808 0.156837
H 4.785583 1.200260 0.813814
H 4.315088 0.622907 -0.820260
H 4.499995 -1.320650 0.827448
H 3.243832 -0.543216 1.856912
H 1.843632 0.897920 -1.832267
H 0.465316 1.643840 -0.938489
H -2.969477 1.727161 -0.086821
H -5.076110 -0.405311 0.257446
H -5.370732 1.061741 -0.731794
H -5.213716 1.192851 1.056525


