%chk=000037285.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037285

0 1
 S  -0.9668000      -3.127000     -0.2318000    
 O    2.332400      -1.231200      0.5382000    
 O    1.335300      -1.589200      -1.507900    
 N    1.566400       2.342900     -6.9300003E-02
 C    2.639200      0.1296000      0.2360000    
 C    1.341500      0.9410000      0.2558000    
 C    3.660400      0.6099000       1.259200    
 C   0.3009000       3.080000     -8.2199998E-02
 C    2.240700       2.472200      -1.362900    
 C    1.460200      -1.848900     -0.3193000    
 C   0.6903000      -2.890700      0.4528000    
 C   -1.667500      -1.488100     -5.7000000E-02
 C   -2.755400       1.056800      0.2146000    
 C   -1.776900     -0.9171000       1.206100    
 C   -2.096900     -0.7988000      -1.185600    
 C   -2.322600      0.3593000       1.342400    
 C   -2.642400      0.4777000      -1.049400    
 C   -3.338500       2.421600      0.3601000    
 H    3.116200      0.1291000     -0.7503000    
 H   0.8928000      0.8572000       1.254400    
 H   0.6069000      0.5229000     -0.4390000    
 H    4.535600     -4.9300000E-02   1.259500    
 H    3.244000      0.5728000       2.272100    
 H    4.000200       1.629700       1.058100    
 H   0.4825000       4.148600     -0.2425000    
 H  -0.2056000       2.992900      0.8850000    
 H  -0.3746000       2.726500     -0.8684000    
 H    2.272200       3.524600      -1.670900    
 H    1.734100       1.910400      -2.156400    
 H    3.289200       2.163800      -1.314200    
 H   0.6069000      -2.601200       1.504600    
 H    1.241300      -3.834100      0.3978000    
 H   -1.453300      -1.445100       2.099100    
 H   -2.015000      -1.234600      -2.177900    
 H   -2.407100      0.7989000       2.332700    
 H   -2.976400       1.011300      -1.935300    
 H   -3.112100       3.042300     -0.5135000    
 H   -4.425200       2.355500      0.4720000    
 H   -2.927500       2.937300       1.234600    


%chk=000037285-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037285

0 1
S -0.989520 -3.381265 -0.150937
O 1.950519 -0.952198 0.857120
O 1.496818 -1.601513 -1.343113
N 2.131590 2.553260 -0.524384
C 2.653786 0.285775 0.359331
C 1.595567 1.410938 0.250192
C 3.766729 0.590786 1.357302
C 1.594710 3.859907 -0.095832
C 2.012125 2.357731 -1.985333
C 1.402804 -1.797760 -0.109986
C 0.715591 -2.969248 0.575891
C -1.836035 -1.748259 0.042523
C -3.209110 0.737174 0.282142
C -2.576988 -1.458730 1.211151
C -1.778298 -0.803878 -1.009165
C -3.253444 -0.223308 1.326485
C -2.459026 0.428011 -0.882545
C -3.968856 2.047352 0.396368
H 3.057693 0.054275 -0.642670
H 1.342024 1.754259 1.270266
H 0.662693 0.995281 -0.199954
H 4.546350 -0.190004 1.343473
H 3.362415 0.665146 2.382663
H 4.223487 1.557963 1.083013
H 2.111374 4.668211 -0.644738
H 1.781153 4.007533 0.982538
H 0.495492 3.972415 -0.277653
H 2.577285 3.145963 -2.514299
H 0.950250 2.389893 -2.338551
H 2.429740 1.379752 -2.278113
H 0.625721 -2.775918 1.654107
H 1.301644 -3.890475 0.410275
H -2.624697 -2.196372 2.019171
H -1.198615 -1.036119 -1.908038
H -3.825513 -0.005337 2.236589
H -2.411764 1.154653 -1.702821
H -3.470228 2.856510 -0.165855
H -4.992938 1.947116 -0.013087
H -4.067127 2.369983 1.447776


