%chk=000003769.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003769

0 1
 S   -4.095600     -0.1034000      6.7900002E-02
 O   -4.703800      -1.430200      0.7940000    
 O   -4.547800     -7.7200003E-02  -1.308000    
 O   -4.265400       1.030100      0.9538000    
 O   0.5175000       1.871900      0.3775000    
 N   -1.521300      0.3103000     -0.6480000    
 N  -0.2024000     -0.1127000     -0.5845000    
 N    4.713100     -0.7691000      0.1002000    
 C   -2.378700     -0.6029000      0.1011000    
 C    2.133600      0.2146000      6.9999998E-04
 C   0.7456000      0.7439000     -5.3100001E-02
 C    3.184900       1.099100     -3.5300002E-02
 C    2.324800      -1.143800      8.4600002E-02
 C    4.458500      0.5560000      1.7300000E-02
 C    3.637000      -1.586500      0.1316000    
 H   -2.084200     -0.6449000       1.155400    
 H   -2.333900      -1.609800     -0.3292000    
 H   -1.789200      0.2961000      -1.631600    
 H   1.7600000E-02  -1.014000     -0.9957000    
 H    3.051200       2.172300     -0.1063000    
 H    1.523900      -1.870200      0.1451000    
 H    5.335900       1.193800     -8.0000004E-03
 H    3.863900      -2.645000      0.2057000    
 H   -4.704300      -2.251000      0.2475000    


%chk=000003769-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003769

0 1
S -2.824365 -0.353577 2.168817
O -3.906891 -1.136785 0.754469
O -2.941431 -1.384736 3.400240
O -1.255990 -0.640284 1.476555
O 0.881089 0.352514 -2.611955
N -1.487943 -0.162310 -1.946719
N -0.602237 -0.181916 -0.891225
N 4.099637 0.089668 1.334448
C -2.778014 -0.405299 -1.910607
C 1.827560 0.085223 -0.388665
C 0.702820 0.100108 -1.365372
C 3.105466 0.480854 -0.865987
C 1.704587 -0.313900 0.968290
C 4.198986 0.469084 0.022968
C 2.864338 -0.292806 1.776937
H -3.284471 -0.679623 -0.965676
H -3.314534 -0.337283 -2.860447
H -0.960236 0.082760 -2.829306
H -1.040286 -0.395889 0.358012
H 3.221861 0.784505 -1.910222
H 0.750545 -0.632344 1.403921
H 5.197559 0.770372 -0.311471
H 2.808501 -0.595544 2.827999
H -4.085650 -2.075390 1.047696


