%chk=000148462.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148462

0 1
 S    2.217700      0.5201000      0.4965000    
 O    2.508300       1.946900      0.5102000    
 O    2.662500     -0.3194000       1.600000    
 O   -4.191700      -1.252600      0.2345000    
 O   -4.322900      0.7221000     -0.7156000    
 N    2.795700     -0.1462000     -0.9668000    
 N   -3.657300     -0.1927000     -0.1725000    
 C    3.080300      -1.575100     -0.9125000    
 C    4.191500     -0.5665000     -0.9327000    
 C   0.4954000      0.3108000      0.2997000    
 C  -0.1206000     -0.8592000      0.7444000    
 C  -0.2649000       1.314000     -0.3014000    
 C   -1.496400      -1.026200      0.5876000    
 C   -1.640900       1.147000     -0.4579000    
 C   -2.256700     -2.3100000E-02 -1.3500000E-02
 H    2.828500      -2.078100      -1.835000    
 H    2.853000      -2.098700      1.6000000E-03
 H    4.729400     -0.3472000     -2.3499999E-02
 H    4.699900     -0.3791000      -1.866700    
 H   0.4524000      -1.655400       1.211100    
 H   0.1950000       2.230300     -0.6607000    
 H   -1.941900      -1.951100      0.9448000    
 H   -2.201300       1.948900     -0.9320000    


%chk=000148462-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148462

0 1
S 2.139016 0.104859 0.674688
O 2.645193 1.655718 0.677851
O 2.460689 -0.893496 1.924982
O -4.574023 -0.939144 0.162564
O -4.426572 1.099946 -0.849866
N 2.735871 -0.750977 -0.998717
N -3.906441 0.082219 -0.253529
C 3.988082 -1.597537 -0.724616
C 4.137010 -0.237596 -1.365414
C 0.279045 0.090074 0.372343
C -0.451692 -1.016422 0.834481
C -0.290007 1.199540 -0.273612
C -1.846464 -1.017740 0.626798
C -1.684881 1.196787 -0.480576
C -2.431983 0.085778 -0.031496
H 4.022142 -2.507898 -1.330336
H 4.285445 -1.720816 0.324384
H 4.538979 0.587275 -0.764192
H 4.280960 -0.140480 -2.445492
H 0.052308 -1.835499 1.356527
H 0.334805 2.042771 -0.583362
H -2.477390 -1.844854 0.961280
H -2.195093 2.026992 -0.975091


