%chk=000091823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091823

0 1
 S    2.258500     -0.4496000     -8.2300000E-02
 O    2.813200     -2.9700000E-02   1.395800    
 O    2.409400      -1.890800     -0.2021000    
 O    2.851000      0.4460000      -1.061300    
 N   0.9734000       2.314000     -1.5200000E-02
 C   -1.731300     -0.9021000     -1.0600000E-02
 C   0.5447000     -9.2100002E-02 -4.3200001E-02
 C   -2.198800      0.4119000      1.7200001E-02
 C   7.7399999E-02   1.221900     -1.4800000E-02
 C  -0.3596000      -1.154200     -4.0899999E-02
 C   -1.294400       1.473900      1.5300000E-02
 C   -2.680700      -2.054900     -1.0500000E-02
 C   -3.662800      0.7059000      5.2600000E-02
 H  -1.2800000E-02  -2.183500     -6.0400002E-02
 H   -1.655500       2.499800      3.7900001E-02
 H   -2.154700      -3.015800     -2.8899999E-02
 H   -3.300100      -2.044400      0.8922000    
 H   -3.325300      -2.023300     -0.8948000    
 H   -4.119100      0.2835000      0.9536000    
 H   -3.860500       1.783500      6.5099999E-02
 H   -4.159900      0.2977000     -0.8334000    
 H    1.973000       2.168500     -2.1400001E-02
 H   0.6108000       3.258200      7.1000000E-03
 H    2.422600     -0.5283000       2.151600    


%chk=000091823-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091823

0 1
S 2.280442 -0.484338 -0.010854
O 2.504010 -0.525041 1.842636
O 2.544995 -1.978756 -0.568554
O 3.189497 0.749630 -0.574895
N 0.943338 2.389984 -0.143778
C -1.797623 -0.905771 0.018549
C 0.490700 -0.044155 -0.043997
C -2.261599 0.454019 -0.005258
C 0.074575 1.320318 -0.078311
C -0.410291 -1.129078 0.007414
C -1.343430 1.515967 -0.058191
C -2.767954 -2.070931 0.061439
C -3.748939 0.748675 0.015364
H -0.010002 -2.148703 0.021857
H -1.716906 2.547059 -0.086479
H -2.231658 -3.034283 0.080611
H -3.417262 -2.030077 0.957228
H -3.438920 -2.077991 -0.819200
H -4.223694 0.346536 0.930637
H -3.950411 1.831936 -0.023350
H -4.263826 0.274954 -0.841895
H 1.949053 2.223691 -0.267548
H 0.577320 3.337786 -0.161883
H 3.447086 -0.815333 2.017058


