%chk=000111323.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111323

0 1
 S  -0.2619000      0.3506000      -1.109300    
 O    3.993300      -1.924200      1.9200001E-02
 O    2.427400      -1.752700       1.650300    
 O   -3.676300       2.424700      0.6641000    
 O   -1.653300       2.360700     -0.1859000    
 N   0.7835000     -0.4887000     -0.1414000    
 N   -2.717700       1.796600      0.1582000    
 C    2.722900       1.077900      5.4499999E-02
 C    2.229600     -0.3399000     -0.3290000    
 C    4.247900       1.279300     -0.1099000    
 C    2.294200       1.448900       1.482900    
 C    4.782000       1.060600      -1.519200    
 C    2.869500      -1.392000      0.5664000    
 C   -1.810800     -0.3700000     -0.5907000    
 C   -2.842100      0.3908000     -3.2099999E-02
 C   -1.981600      -1.747300     -0.7568000    
 C   -4.033800     -0.2208000      0.3572000    
 C   -3.173400      -2.358900     -0.3677000    
 C   -4.199400      -1.595700      0.1893000    
 H    2.246100       1.803200     -0.6190000    
 H    2.477000     -0.5813000      -1.369600    
 H    4.794200      0.6313000      0.5855000    
 H    4.494700       2.308500      0.1817000    
 H    1.208200       1.462400       1.608800    
 H    2.727100      0.7796000       2.232200    
 H    2.640900       2.461000       1.723400    
 H    4.681800      1.8400000E-02  -1.833600    
 H    5.844900       1.319000      -1.562300    
 H    4.250500       1.691100      -2.238900    
 H   0.5350000     -0.3817000      0.8407000    
 H    4.393300      -2.607700      0.5980000    
 H   -1.201400      -2.366100      -1.194200    
 H   -4.859200      0.3347000      0.7951000    
 H   -3.303200      -3.429100     -0.4998000    
 H   -5.127200      -2.072500      0.4918000    


%chk=000111323-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111323

0 1
S -0.429433 1.066108 0.953682
O 3.557620 -2.062133 -0.038724
O 2.823595 -1.859588 2.153195
O -4.317699 2.415244 -0.782351
O -2.325412 2.705222 0.296622
N 0.791590 -0.194262 1.298419
N -3.224968 1.953514 -0.274630
C 2.870221 1.048061 0.423469
C 1.999060 -0.269072 0.447305
C 3.989361 1.033676 -0.652524
C 3.437352 1.397482 1.817526
C 3.496291 0.839383 -2.103798
C 2.802342 -1.456125 0.968087
C -1.739687 -0.011806 0.193449
C -2.953669 0.514586 -0.329118
C -1.541392 -1.410392 0.118795
C -3.939223 -0.321008 -0.913675
C -2.516152 -2.246946 -0.456679
C -3.719961 -1.705164 -0.978814
H 2.142400 1.836293 0.133177
H 1.687265 -0.490834 -0.588422
H 4.733815 0.251082 -0.408119
H 4.521101 2.003553 -0.578904
H 2.650827 1.401561 2.593805
H 4.218853 0.680833 2.132009
H 3.892069 2.404249 1.799500
H 3.116383 -0.183521 -2.275115
H 4.321870 1.003648 -2.819964
H 2.689709 1.555211 -2.352278
H 0.951026 -0.372979 2.296443
H 4.089830 -2.808793 0.352145
H -0.608095 -1.805075 0.536790
H -4.850295 0.145623 -1.298244
H -2.339431 -3.327267 -0.497345
H -4.474462 -2.359664 -1.425815


