%chk=000001080.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001080

0 1
 S   0.6021000      0.1695000      0.4778000    
 O   -2.748300       1.728900      0.5183000    
 O   -2.483600      0.6926000      -1.482200    
 O    4.200500     -0.2029000     -0.9384000    
 O    3.425200      0.9241000      0.8767000    
 N   -3.071600      -1.618800      0.2433000    
 C   -2.075600     -0.5847000      0.5307000    
 C  -0.6775000      -1.089400      0.1690000    
 C   -2.461700      0.6530000     -0.2575000    
 C    2.026000     -0.7549000     -0.1396000    
 C    3.264400      8.2599998E-02  1.9000000E-03
 H   -2.119100     -0.3537000       1.602100    
 H  -0.4346000      -1.980300      0.7588000    
 H  -0.6344000      -1.360600     -0.8924000    
 H    1.865100     -0.9816000      -1.197700    
 H    2.163500      -1.680900      0.4253000    
 H   -3.984700      -1.317200      0.5821000    
 H   -2.843300      -2.466500      0.7614000    
 H   -2.978000       2.516700     -1.9099999E-02
 H    5.006500      0.3457000     -0.8307000    


%chk=000001080-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000001080

0 1
S 0.879715 -0.902427 1.313191
O -2.927348 1.358244 -0.195132
O -0.926308 0.718275 -1.168566
O 3.884693 0.248263 -1.158360
O 3.461272 0.705823 1.081530
N -3.173155 -1.350248 0.439149
C -1.908639 -0.626778 0.699261
C -0.719895 -1.600029 0.570897
C -1.817377 0.513684 -0.318688
C 1.810073 -0.543941 -0.289944
C 3.096478 0.193098 0.004327
H -1.861225 -0.147103 1.707152
H -0.940539 -2.519613 1.139014
H -0.548086 -1.871888 -0.482320
H 1.159774 0.072621 -0.934768
H 2.040616 -1.484773 -0.816306
H -3.992495 -0.738957 0.368717
H -3.322589 -2.149764 1.061538
H -2.870874 2.088531 -0.869359
H 4.716810 0.758580 -0.961532


