%chk=000026486.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026486

0 1
 S    1.500300     -0.6722000       2.678700    
 P    1.445400      3.5399999E-02  0.8513000    
 O  -1.9999999E-04  0.6648000      0.4478000    
 O    2.349500       1.386900      0.6785000    
 O   -3.439500       2.625400     -0.5384000    
 O   -1.312600       2.709500     -1.6000000E-03
 N    1.901300     -0.9608000     -0.4051000    
 N   -2.361600       2.062700     -0.2323000    
 C    3.164400      -1.681600     -0.3491000    
 C    4.327700     -0.7326000     -0.6228000    
 C    3.141500      -2.825700      -1.357700    
 C   -1.155300     -2.5699999E-02  0.1932000    
 C   -2.328000      0.6439000     -0.1432000    
 C   -1.135900      -1.414900      0.2771000    
 C   -2.299400      -2.140600      2.2200000E-02
 C    2.258100       2.164700     -0.5042000    
 C   -3.491600     -8.1900001E-02 -0.3981000    
 C   -3.477300      -1.474200     -0.3154000    
 C   -2.284500      -3.629400      0.1103000    
 C    3.197700       3.346200     -0.3913000    
 H    3.298300      -2.127600      0.6419000    
 H    1.746800     -0.6076000      -1.348800    
 H    5.272200      -1.287600     -0.6541000    
 H    4.216900     -0.2209000      -1.585000    
 H    4.429100      2.1400001E-02  0.1629000    
 H    2.312300      -3.512300      -1.153000    
 H    4.070700      -3.403700      -1.308600    
 H    3.030100      -2.457000      -2.383800    
 H  -0.2496000      -1.976500      0.5433000    
 H    2.526400       1.559800      -1.374000    
 H    1.237200       2.528900     -0.6347000    
 H   -4.428800      0.4008000     -0.6635000    
 H   -4.391200      -2.027600     -0.5147000    
 H   -3.119400      -4.073200     -0.4426000    
 H   -1.362600      -4.035100     -0.3202000    
 H   -2.356100      -3.944700       1.156100    
 H    3.150500       3.970700      -1.287700    
 H    2.944000       3.958800      0.4802000    
 H    4.229100       3.005700     -0.2519000    


%chk=000026486-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026486

0 1
S 2.067415 -1.557494 2.303845
P 1.727502 -0.117788 0.875251
O 0.046293 0.494120 0.564089
O 2.344748 1.414021 1.377447
O -2.051645 1.273836 -2.887812
O 0.095251 0.989151 -2.205928
N 2.110177 -0.512403 -0.739235
N -1.178816 0.750621 -2.094980
C 3.174374 -1.457417 -1.160467
C 4.455611 -0.703734 -1.587151
C 2.628892 -2.358428 -2.289434
C -0.996911 -0.348181 0.190311
C -1.657225 -0.180964 -1.063880
C -1.508418 -1.298631 1.103366
C -2.649488 -2.078418 0.800002
C 2.225654 2.599250 0.466197
C -2.827927 -0.920538 -1.360028
C -3.308211 -1.869885 -0.444332
C -3.177654 -3.084081 1.803086
C 3.091390 3.689735 1.089468
H 3.403574 -2.087982 -0.278785
H 1.542758 -0.033681 -1.458804
H 5.250447 -1.419077 -1.868010
H 4.253181 -0.053644 -2.458676
H 4.831435 -0.073774 -0.761438
H 1.739824 -2.916980 -1.949669
H 3.400483 -3.082848 -2.605868
H 2.348108 -1.754755 -3.173472
H -0.997401 -1.410317 2.065467
H 2.579877 2.317954 -0.545132
H 1.161598 2.886951 0.409863
H -3.329881 -0.745771 -2.315787
H -4.199205 -2.456502 -0.691440
H -3.804628 -3.851019 1.317821
H -2.355376 -3.592147 2.335797
H -3.800372 -2.581727 2.568546
H 3.034779 4.607405 0.474683
H 2.740496 3.928027 2.107591
H 4.145191 3.369315 1.149202


