%chk=000101001.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101001

1 1
 S    2.826900      0.3955000      0.3732000    
 O    2.930000       1.240800      -1.024600    
 O   -3.327800      -1.432900     -0.2800000    
 O    2.485500       1.308600       1.449400    
 O    3.997300     -0.4617000      0.4573000    
 N   -3.825200       1.262000     -1.9999999E-04
 N   -4.848000       1.640800     -2.7700000E-02
 C   0.1138000     -0.1603000      0.1144000    
 C    1.430300     -0.6479000      0.1518000    
 C  -0.9557000      -1.068900     -6.7400001E-02
 C  -0.1645000       1.209300      0.2533000    
 C    1.688600      -2.011800      1.1800000E-02
 C   -2.272200     -0.5814000     -0.1048000    
 C  -0.6773000      -2.438400     -0.2065000    
 C   0.6367000      -2.905300     -0.1671000    
 C   -2.530500      0.7825000      3.5000000E-02
 C   -1.478600       1.676100      0.2135000    
 C    3.970700       2.193100      -1.181200    
 H   0.5971000       1.973300      0.3459000    
 H    2.694700      -2.419200      3.2000002E-02
 H   -1.456100      -3.178900     -0.3654000    
 H   0.8387000      -3.966600     -0.2806000    
 H   -1.671900       2.741200      0.3126000    
 H   -3.126700      -2.299100      0.1075000    
 H    3.873100       2.656600      -2.166100    
 H    4.945300       1.701600      -1.115700    
 H    3.890400       2.969000     -0.4148000    


%chk=000101001-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101001

1 1
S 2.900123 0.510850 0.606863
O 2.854519 1.287937 -1.080982
O -3.434104 -1.379147 -0.363834
O 2.531050 1.619510 1.728144
O 4.201214 -0.432679 0.767488
N -3.903396 1.176958 0.054942
N -5.013078 1.515017 0.007006
C 0.076132 -0.101738 0.218206
C 1.403403 -0.615975 0.251685
C -0.973805 -1.073331 -0.058847
C -0.249628 1.288774 0.441523
C 1.725387 -1.954681 0.043359
C -2.329838 -0.610558 -0.112524
C -0.644097 -2.453208 -0.273683
C 0.679830 -2.888804 -0.219555
C -2.599902 0.775726 0.111275
C -1.556226 1.731321 0.390857
C 4.083815 2.053489 -1.416116
H 0.550856 1.995050 0.677681
H 2.772465 -2.276188 0.090997
H -1.421322 -3.198984 -0.481379
H 0.923602 -3.942022 -0.381342
H -1.812865 2.779922 0.562020
H -3.259233 -2.341287 -0.518287
H 3.914317 2.354485 -2.463187
H 4.979237 1.411426 -1.350960
H 4.186146 2.946137 -0.775750


