%chk=000171048.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171048

0 1
 S    3.966800     -0.5675000     -3.3000000E-03
 P    2.072000     -0.1810000     -1.3000000E-03
 O    1.212100     -0.7195000      -1.271800    
 O    1.643200       1.387000      2.9100001E-02
 O    1.204300     -0.7704000       1.240800    
 C  -0.5819000      0.3604000      1.3000000E-03
 C   -2.079000      0.6659000      2.7000001E-03
 C  -0.1874000     -0.4316000      -1.266700    
 C   0.2422000       1.668300      3.0800000E-02
 C  -0.1953000     -0.4829000       1.238200    
 C   -2.903800     -0.6162000      1.2600000E-02
 C   -4.393300     -0.3124000     -1.2500000E-02
 H   -2.339600       1.264900     -0.8793000    
 H   -2.337000       1.271900      0.8807000    
 H  -0.6891000      -1.399500      -1.332000    
 H  -0.4175000      0.1344000      -2.175500    
 H   2.4800001E-02   2.291600     -0.8430000    
 H   2.0000000E-02   2.255000      0.9285000    
 H  -0.4330000      4.3499999E-02   2.168600    
 H  -0.6941000      -1.454500       1.257300    
 H   -2.716800      -1.209500      0.9118000    
 H   -2.690700      -1.245600     -0.8552000    
 H   -4.688200      0.2805000      0.8594000    
 H   -4.665500      0.2446000     -0.9149000    
 H   -4.971400      -1.241900     -1.3000000E-03


%chk=000171048-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171048

0 1
S 4.243238 -0.420449 -0.002721
P 2.241654 -0.117758 -0.000789
O 1.334587 -0.743067 -1.360782
O 1.681846 1.540109 0.024264
O 1.330871 -0.784884 1.336537
C -0.548668 0.290732 0.002103
C -2.078739 0.579579 0.003989
C -0.142723 -0.484883 -1.281701
C 0.187330 1.664044 0.028744
C -0.147510 -0.533122 1.256764
C -3.022504 -0.649508 0.008374
C -4.504330 -0.217648 -0.011295
H -2.315615 1.202391 -0.883685
H -2.313262 1.205680 0.889956
H -0.623673 -1.477437 -1.321601
H -0.407613 0.091841 -2.187009
H -0.077346 2.263129 -0.862140
H -0.075411 2.227508 0.943162
H -0.422206 0.004469 2.182996
H -0.622791 -1.529172 1.252821
H -2.836747 -1.270549 0.905828
H -2.818724 -1.292111 -0.869853
H -4.749498 0.403509 0.870462
H -4.733667 0.376716 -0.915462
H -5.176699 -1.093619 -0.003962


