%chk=000125860.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125860

0 1
 S    4.327600     -0.5718000     -0.5058000    
 O   -4.371400       1.194300     -0.5001000    
 N  -0.1083000     -0.6753000      5.8899999E-02
 N   -2.184800      0.5535000      8.8699996E-02
 C   -1.512400     -0.6686000      0.4928000    
 C   0.5993000      0.5586000      0.5206000    
 C  -9.1799997E-02   1.788100     -0.1003000    
 C   -2.377500      -1.729000     -0.1867000    
 C   -1.559500       1.843300      0.2972000    
 C   0.5907000      -1.899600      0.5028000    
 C    2.064600      0.4777000      0.1532000    
 C   -3.780700      -1.130800     -0.1466000    
 C   -3.524400      0.3545000     -0.2359000    
 C    1.957700      -2.031200     -0.1916000    
 C    2.673500     -0.7241000     -0.1509000    
 C    3.017700       1.545000      0.1279000    
 C    4.279600       1.115400     -0.2242000    
 H   -1.598200     -0.7414000       1.585600    
 H   0.5399000      0.6264000       1.616800    
 H  -1.0500000E-02   1.745500      -1.195200    
 H   0.3956000       2.717500      0.2160000    
 H   -2.329500      -2.704200      0.3068000    
 H   -2.077600      -1.865700      -1.234400    
 H   -1.660100       2.082600       1.362200    
 H   -2.098500       2.611000     -0.2673000    
 H   1.5400000E-02  -2.798600      0.2553000    
 H   0.7176000      -1.889800       1.593900    
 H   -4.281200      -1.346300      0.8025000    
 H   -4.393600      -1.474600     -0.9831000    
 H    1.811200      -2.326700      -1.238100    
 H    2.541900      -2.817100      0.3004000    
 H    2.794800       2.579300      0.3559000    
 H    5.175100       1.712500     -0.3242000    


%chk=000125860-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125860

0 1
S 4.397895 -0.550912 -0.621297
O -4.233142 1.292359 -0.750733
N -0.122652 -0.685419 0.113276
N -2.206390 0.556380 0.198290
C -1.522998 -0.674055 0.620044
C 0.604799 0.559479 0.525887
C -0.102959 1.785736 -0.103815
C -2.405079 -1.803147 0.006854
C -1.564926 1.859648 0.381390
C 0.605605 -1.919987 0.507729
C 2.071927 0.462461 0.140355
C -3.772045 -1.135787 -0.294721
C -3.474212 0.370716 -0.338770
C 1.907884 -2.051595 -0.315956
C 2.642547 -0.741068 -0.242306
C 3.014554 1.561361 0.154570
C 4.294084 1.199807 -0.224980
H -1.518646 -0.724017 1.744242
H 0.546127 0.675426 1.645103
H -0.065165 1.690392 -1.203002
H 0.423858 2.713322 0.185959
H -2.495011 -2.672135 0.678579
H -1.926923 -2.128454 -0.933526
H -1.590771 2.146329 1.455229
H -2.157501 2.601495 -0.181023
H -0.040497 -2.792064 0.309569
H 0.854981 -1.924141 1.598668
H -4.519189 -1.320819 0.499225
H -4.219637 -1.459461 -1.248151
H 1.654922 -2.300063 -1.364892
H 2.519295 -2.882607 0.085238
H 2.754366 2.585384 0.434919
H 5.187097 1.815835 -0.308855


