%chk=000145566.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145566

0 1
 S    1.127500      -3.290300      0.7249000    
 O   -2.439500       1.040400      0.6848000    
 O    2.080700      0.9696000      0.8582000    
 O   -2.684000     -0.7374000     -0.7624000    
 O    2.461600       1.111700      -1.412500    
 N  -5.8100000E-02  -1.262200     -0.7346000    
 C  -0.4807000     -9.0700001E-02  4.2100001E-02
 C   0.1956000       1.156600     -0.5221000    
 C   -1.986600      4.1000000E-03 -8.2300000E-02
 C    1.705800       1.080800     -0.4512000    
 C   -3.855500       1.248100      0.6682000    
 C    3.490300      0.8839000       1.090500    
 C   0.4431000      -2.114700     -0.1036000    
 H  -0.2525000     -0.2000000       1.113100    
 H  -0.1235000       2.065100      1.9000000E-03
 H  -8.0100000E-02   1.294800      -1.575500    
 H   -4.372300      0.3644000       1.054400    
 H   -4.192000       1.480900     -0.3466000    
 H   -4.081900       2.098500       1.316800    
 H    3.652500      0.7989000       2.168300    
 H    3.989200       1.788600      0.7302000    
 H    3.900600     -5.2999998E-03  0.6025000    


%chk=000145566-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145566

0 1
S 0.239070 -4.135005 -0.775257
O -2.376301 1.127723 0.663771
O 2.108197 1.063557 0.899155
O -2.639572 -1.006074 -0.246924
O 2.573228 1.396956 -1.359738
N 0.162354 -1.390697 -0.061357
C -0.364143 -0.106461 0.272807
C 0.248581 1.009215 -0.626180
C -1.910295 -0.091306 0.178206
C 1.752968 1.165818 -0.446967
C -3.853285 1.303276 0.656282
C 3.554848 1.212146 1.197128
C 0.134953 -2.564174 -0.368579
H -0.095178 0.134735 1.319092
H -0.236044 1.965202 -0.357214
H 0.053812 0.804511 -1.691255
H -4.324812 0.541223 1.298342
H -4.240654 1.207130 -0.371350
H -4.015699 2.314692 1.052367
H 3.632258 1.081363 2.285115
H 3.904923 2.211035 0.887814
H 4.130990 0.440935 0.659842


