%chk=000134888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134888

0 1
 S   0.8452000      -1.285900      -2.272500    
 O   -2.407200      -2.539700      0.1342000    
 O   -3.390800      -1.222100       2.031700    
 O   -2.685400      0.8902000       2.356400    
 N   -2.068100     -0.2473000      0.3857000    
 C   0.7860000     -0.5598000     -0.5854000    
 C   1.1300000E-02  0.7558000     -0.5969000    
 C   -1.303100      0.8788000     -8.5299999E-02
 C    2.149900     -0.4535000      0.1000000    
 C  -0.7566000      -2.157400      -2.336300    
 C   -1.957100      -1.339900      -1.872000    
 C   0.6367000       1.914300      -1.109100    
 C   -2.164000      -1.434500     -0.3629000    
 C   -1.910300       2.151800     -4.4500001E-02
 C    2.249000     -0.6548000       1.472600    
 C    3.279500     -0.1560000     -0.6549000    
 C   1.2000000E-02   3.160500      -1.076500    
 C   -1.258200       3.281100     -0.5343000    
 C   -2.713400     -0.1052000       1.636500    
 C    3.492400     -0.5575000       2.097500    
 C    4.522800     -5.9099998E-02 -3.0099999E-02
 C    4.629300     -0.2599000       1.346100    
 H   0.2626000      -1.304400      2.0600000E-02
 H  -0.6573000      -3.086500      -1.765400    
 H  -0.9058000      -2.442100      -3.383300    
 H   -2.861700      -1.788600      -2.305700    
 H   -1.942800     -0.3158000      -2.253000    
 H    1.632000       1.865800      -1.542000    
 H   -2.928800       2.276600      0.3170000    
 H    1.370600     -0.8842000       2.069500    
 H    3.238200      2.6000001E-02  -1.724000    
 H   0.5211000       4.033900      -1.473000    
 H   -1.751800       4.248000     -0.5100000    
 H    3.575200     -0.7126000       3.169300    
 H    5.407600      0.1773000     -0.6140000    
 H    5.597100     -0.1832000       1.832800    
 H   -3.819100      -1.097300       2.905400    


%chk=000134888-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134888

0 1
S 0.841082 -1.096885 -2.400595
O -2.533899 -2.632706 -0.105121
O -3.507389 -1.157293 1.992211
O -1.704074 0.172707 2.625276
N -2.067964 -0.361410 0.346798
C 0.770061 -0.522465 -0.559000
C -0.008408 0.784388 -0.500925
C -1.366088 0.838003 -0.092041
C 2.165848 -0.419172 0.066917
C -0.816536 -1.999573 -2.556167
C -2.057380 -1.234309 -2.027513
C 0.612079 1.998928 -0.895846
C -2.260443 -1.483903 -0.530951
C -2.077938 2.060768 -0.073304
C 2.240832 0.054077 1.406245
C 3.359338 -0.796667 -0.591850
C -0.088307 3.219269 -0.877674
C -1.442616 3.254800 -0.462899
C -2.361005 -0.419594 1.739578
C 3.483039 0.144190 2.067501
C 4.606283 -0.698101 0.070304
C 4.674164 -0.229425 1.400330
H 0.222089 -1.323817 -0.033840
H -0.743516 -2.981898 -2.060428
H -0.903356 -2.156243 -3.644689
H -2.947982 -1.678315 -2.512577
H -2.014416 -0.167762 -2.297557
H 1.659927 1.971725 -1.213424
H -3.125147 2.062513 0.248623
H 1.321919 0.349041 1.928360
H 3.317781 -1.180453 -1.616511
H 0.415569 4.142623 -1.183010
H -1.993644 4.200803 -0.446115
H 3.521605 0.504390 3.101638
H 5.521844 -0.993095 -0.454791
H 5.640111 -0.157709 1.912638
H -3.616462 -1.254634 2.974611


