%chk=000096284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096284

0 1
 S   -2.072100     -0.1065000      8.1699997E-02
 O   -2.407000      0.8203000      -1.217600    
 O   -2.567600      0.5795000       1.260400    
 O   -2.486600      -1.464600     -0.2165000    
 O    3.662600      0.1998000     -4.9000001E-03
 N    1.629300       1.208500     -1.4300000E-02
 N    1.824700      -1.149200      6.9999998E-04
 N  -0.4014000       2.395900      1.8900000E-02
 N  -3.7200000E-02  -2.501000      2.2800000E-02
 C  -0.3501000     -1.5500000E-02  4.8200000E-02
 C   0.2509000       1.190400      8.7000001E-03
 C   0.5182000      -1.240900      1.5100000E-02
 C    2.436200      8.3499998E-02 -3.4000000E-03
 H    2.075300       2.121000     -2.8500000E-02
 H   -1.410900       2.444000      5.0999999E-02
 H   0.1452000       3.247500      1.9000000E-03
 H   0.5555000      -3.324300      8.0000004E-03
 H   -1.036600      -2.662200      5.7999998E-02
 H   -2.114500      0.4574000      -2.086800    


%chk=000096284-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096284

0 1
S -2.070535 -0.074732 -0.054627
O -2.235345 0.074130 -1.907244
O -2.770832 1.253767 0.595643
O -2.654015 -1.535430 0.361047
O 3.811373 0.256658 -0.128865
N 1.737568 1.266128 0.145410
N 1.905175 -1.132265 -0.133643
N -0.298206 2.443764 0.363526
N -0.004607 -2.441832 -0.135236
C -0.264468 -0.006924 0.083538
C 0.365798 1.265023 0.199322
C 0.555517 -1.200106 -0.065403
C 2.569637 0.072399 -0.059594
H 2.271362 2.134981 0.247926
H -1.323750 2.418999 0.491106
H 0.200449 3.330926 0.386935
H 0.636757 -3.225576 -0.250789
H -1.012043 -2.583257 -0.000897
H -3.205934 -0.033053 -2.134756


