%chk=000128262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128262

0 1
 I    1.132700      -3.112600      0.9808000    
 S    3.218700     -0.1986000     -0.5082000    
 O    2.172200     -3.9099999E-02  0.7476000    
 O    4.687500     -0.2070000      0.2040000    
 O    3.017500      -1.493800      -1.131300    
 O    3.131500       1.010500      -1.306600    
 N   0.1142000       3.441000      0.8479000    
 C   -3.375200     -0.2283000     -0.2867000    
 C   -1.864300     -0.1842000     -4.1999999E-03
 C   -3.653500      0.3045000      -1.709000    
 C   -4.121600      0.6510000      0.7399000    
 C   -3.985700      -1.645600     -0.2027000    
 C   -1.228500       1.030900     -5.3700000E-02
 C   -1.220500      -1.361100      0.2847000    
 C   0.1421000       1.071700      0.2028000    
 C   0.8314000     -0.1039000      0.5001000    
 C   0.1501000      -1.320500      0.5410000    
 C   0.8515000       2.385000      0.1538000    
 H   -3.104700     -0.2743000      -2.461400    
 H   -4.720500      0.2388000      -1.952600    
 H   -3.366000       1.354700      -1.827700    
 H   -3.839300       1.707200      0.6708000    
 H   -5.206200      0.6017000      0.5866000    
 H   -3.915400      0.3216000       1.765300    
 H   -5.062500      -1.617200     -0.4121000    
 H   -3.543800      -2.328000     -0.9385000    
 H   -3.874700      -2.082700      0.7966000    
 H   -1.769000       1.935600     -0.3076000    
 H   -1.720300      -2.320700      0.3240000    
 H    1.835200       2.339700      0.6298000    
 H    1.005100       2.680900     -0.8897000    
 H  -0.1320000       3.140000       1.789600    
 H  -0.7532000       3.661200      0.3638000    
 H    4.831700      0.4966000      0.8794000    


%chk=000128262-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128262

0 1
I 1.067403 -3.438016 0.803562
S 3.587299 -0.178780 -0.906583
O 2.123078 -0.388631 0.910968
O 4.491028 0.981376 0.240826
O 4.734156 -1.142985 -1.524273
O 2.711718 0.716481 -1.953261
N 0.084674 3.390956 0.431234
C -3.508517 -0.259954 -0.226297
C -2.000195 -0.320176 0.077646
C -3.715348 0.411340 -1.621364
C -4.208555 0.605424 0.869485
C -4.176471 -1.658118 -0.248838
C -1.240082 0.887013 0.126960
C -1.325398 -1.560360 0.294172
C 0.136709 0.898208 0.360337
C 0.836684 -0.362562 0.606321
C 0.051856 -1.586993 0.535515
C 0.931008 2.198169 0.362871
H -3.239800 -0.183891 -2.421550
H -4.796863 0.484069 -1.838657
H -3.291081 1.429731 -1.655621
H -3.807117 1.633241 0.899704
H -5.290988 0.669131 0.653719
H -4.081274 0.156310 1.871234
H -5.253240 -1.545028 -0.467736
H -3.746633 -2.308605 -1.032655
H -4.089230 -2.174552 0.725066
H -1.706973 1.863372 -0.040177
H -1.882369 -2.498106 0.256817
H 1.682344 2.143870 1.182256
H 1.525475 2.220888 -0.572876
H -0.273752 3.636461 1.356066
H 0.406265 4.193359 -0.109940
H 3.928690 0.942359 1.071567


