%chk=000131546.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131546

0 1
 S    1.523300       2.156800     -0.6770000    
 O   -3.524500     -0.6906000      -1.683900    
 O   -2.763800      0.5757000       1.574900    
 N   -3.668600     -0.1463000     -0.4025000    
 C    1.189000     -0.4345000      0.3265000    
 C    2.027100      0.4808000     -0.2928000    
 C    1.619300      -1.724300      0.6063000    
 C  -0.1903000     -9.2699997E-02  0.7177000    
 C    3.323300      9.9299997E-02 -0.6400000    
 C    2.915400      -2.105600      0.2591000    
 C    3.767200      -1.194000     -0.3641000    
 C   -1.268300     -0.2720000     -6.1000001E-02
 C   -2.624200      9.6400000E-02  0.4496000    
 C    2.729500       3.121500      0.2729000    
 C   -5.054400      0.1295000     -8.5800000E-02
 H   0.9685000      -2.446900       1.092200    
 H  -0.2784000      0.3217000       1.719000    
 H    4.005600      0.7855000      -1.135600    
 H    3.261100      -3.112600      0.4735000    
 H    4.775600      -1.492000     -0.6363000    
 H   -1.168300     -0.6886000      -1.056900    
 H   -5.619500     -0.8056000     -0.1367000    
 H   -5.450100      0.8308000     -0.8259000    
 H   -5.154800      0.5602000      0.9135000    
 H    2.720500       2.815700       1.322600    
 H    2.463400       4.180400      0.2166000    
 H    3.736200       2.997500     -0.1340000    
 H   -3.680200      -1.632000      -1.496000    


%chk=000131546-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131546

0 1
S 1.780175 2.507857 0.315298
O -3.731983 -1.889133 -0.772222
O -2.954915 1.358336 0.625979
N -3.917244 -0.638959 -0.034576
C 1.060619 -0.199668 0.021065
C 2.160129 0.723985 0.077606
C 1.359475 -1.576160 -0.199550
C -0.322253 0.261469 0.209512
C 3.487351 0.258097 -0.080960
C 2.678667 -2.035425 -0.359605
C 3.747953 -1.111394 -0.296848
C -1.461726 -0.444911 -0.066968
C -2.785847 0.173394 0.188629
C 3.480194 3.251441 0.594627
C -5.274193 -0.092201 -0.149033
H 0.533752 -2.295163 -0.221578
H -0.473275 1.274120 0.611571
H 4.329294 0.955057 -0.044707
H 2.876401 -3.100038 -0.521986
H 4.782436 -1.452259 -0.415236
H -1.447311 -1.441275 -0.516361
H -5.995235 -0.713101 0.411848
H -5.581931 -0.042445 -1.210080
H -5.249686 0.922686 0.277284
H 3.986720 2.761761 1.440818
H 3.288998 4.307217 0.841284
H 4.092570 3.195177 -0.318687
H -3.869537 -2.604366 -0.091222


