%chk=000145888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145888

0 1
 S    2.914100      -2.057700      0.1515000    
 O   -1.980900       1.292000      -1.870200    
 O    2.647200     -0.8333000     -0.9131000    
 O    2.392600       3.508500       1.054200    
 O    3.933200      -3.053100     -0.6456000    
 O    3.616500      -1.533000       1.308100    
 O    1.661600      -2.769900      0.3264000    
 N   -3.806800      0.1529000      4.2100001E-02
 C   -1.710000       1.334500     -0.4698000    
 C   -2.365000      0.1402000      0.2349000    
 C   -4.428900     -0.9878000      0.7128000    
 C  -0.2091000       1.335800     -0.2784000    
 C   -3.871300      -2.295900      0.1587000    
 C   -5.942300     -0.9182000      0.5345000    
 C   0.5256000      0.2375000     -0.6905000    
 C   0.3968000       2.434900      0.3049000    
 C    1.909400      0.2386000     -0.5141000    
 C    1.780400       2.436100      0.4816000    
 C    2.536800       1.337900      7.1999997E-02
 H   -2.138200       2.269200     -8.6599998E-02
 H   -2.115600      0.1590000       1.303400    
 H   -1.945200     -0.7702000     -0.1996000    
 H   -4.222900     -0.9428000       1.789900    
 H   -4.195700       1.021700      0.4074000    
 H   -4.486300      -3.140900      0.4903000    
 H   -3.870700      -2.308100     -0.9373000    
 H   -2.857200      -2.503700      0.5148000    
 H   -6.345700      1.2800000E-02  0.9482000    
 H   -6.432700      -1.749200       1.052900    
 H   -6.224400     -0.9688000     -0.5233000    
 H   5.3500000E-02 -0.6173000      -1.165900    
 H  -0.1867000       3.293400      0.6263000    
 H   -2.946500       1.250700      -1.977700    
 H    3.615800       1.334000      0.2055000    
 H    3.349400       3.339000       1.098300    
 H    3.681000      -3.255800      -1.577100    


%chk=000145888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145888

0 1
S 2.020706 -2.527271 0.362378
O -2.099177 0.845102 -1.775999
O 2.592654 -0.763526 -0.846733
O 2.386296 3.679003 1.163994
O 2.216109 -3.505932 -1.179764
O 2.924486 -3.269123 1.476622
O 0.439284 -2.301308 0.678608
N -3.686367 0.229224 0.166299
C -1.735772 1.580209 -0.580231
C -2.434955 0.858386 0.649214
C -3.995208 -1.160895 0.645042
C -0.228588 1.571832 -0.393504
C -3.026134 -2.187228 0.022105
C -5.458573 -1.478247 0.277175
C 0.507801 0.440141 -0.798070
C 0.438966 2.636646 0.252982
C 1.908290 0.348737 -0.498197
C 1.838233 2.558842 0.529497
C 2.576285 1.416798 0.188702
H -2.101061 2.629194 -0.642231
H -2.593824 1.579153 1.475659
H -1.766285 0.062696 1.018496
H -3.893327 -1.208642 1.754203
H -4.502785 0.846273 0.271839
H -3.273007 -3.201064 0.385966
H -3.116384 -2.179848 -1.079573
H -1.969060 -1.999021 0.282596
H -6.161729 -0.764235 0.748426
H -5.729285 -2.491855 0.619765
H -5.598453 -1.434632 -0.818613
H 0.003609 -0.369579 -1.331074
H -0.096367 3.542963 0.557159
H -2.954065 0.367267 -1.469502
H 3.644456 1.312466 0.410959
H 3.353878 3.562180 1.336106
H 2.301153 -2.801705 -1.890802


