%chk=000074698.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074698

0 1
 S   -4.542800      0.1141000      4.4000000E-02
 S    2.228100      0.1086000      -2.394300    
 P    2.422800      3.0600000E-02 -0.4553000    
 O    1.278400     -0.7716000      0.3665000    
 O    3.771100     -0.6982000      9.5299996E-02
 O    2.487400       1.445300      0.3459000    
 O   -5.207700     -0.9080000      0.8401000    
 O   -4.811300       1.521500      0.3037000    
 N   -4.829200     -0.2026000      -1.610400    
 C   -2.819100     -0.1484000      0.1394000    
 C  -7.2800003E-02 -0.5662000      0.2911000    
 C   -1.939200      0.9117000     -7.8599997E-02
 C   -2.322000      -1.418000      0.4335000    
 C  -0.5622000      0.7023000     -2.6000000E-03
 C  -0.9452000      -1.627600      0.5097000    
 C    3.947800      -2.091800     -9.5200002E-02
 C    3.392800       2.451800     -7.4100003E-02
 C    5.273200      -2.507600      0.5068000    
 C    3.249800       3.654000      0.8346000    
 H   -2.304500       1.907500     -0.3137000    
 H   -2.988500      -2.259500      0.6004000    
 H   8.9699998E-02   1.551300     -0.1713000    
 H  -0.5619000      -2.618100      0.7374000    
 H    3.130600      -2.633600      0.3903000    
 H    3.936200      -2.320500      -1.164900    
 H    4.414000       2.060800     -2.9899999E-02
 H    3.168800       2.745600      -1.103500    
 H    5.441900      -3.580300      0.3776000    
 H    6.098000      -1.960900      3.7900001E-02
 H    5.302000      -2.271300       1.575700    
 H    3.935900       4.452200      0.5380000    
 H    2.225100       4.039200      0.8058000    
 H    3.456700       3.378200       1.873900    
 H   -5.332400      -1.065500      -1.850500    
 H   -5.059500      0.5949000      -2.215600    


%chk=000074698-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000074698

0 1
S -4.747656 0.151949 -0.037671
S 2.287245 -0.050500 -2.383473
P 2.472375 -0.050390 -0.333715
O 1.189996 -0.793141 0.603314
O 3.809244 -0.874433 0.360919
O 2.561580 1.462248 0.479344
O -5.515274 -0.962685 0.868045
O -5.013924 1.754417 0.097024
N -5.093630 -0.338781 -1.779870
C -2.899022 -0.125478 0.128358
C -0.180383 -0.521876 0.399166
C -2.047489 0.976852 -0.045490
C -2.447422 -1.415916 0.451601
C -0.659308 0.775132 0.098653
C -1.058846 -1.614753 0.583048
C 4.199781 -2.212267 -0.189928
C 3.594131 2.452421 0.024917
C 5.556827 -2.540643 0.422446
C 3.269694 3.759353 0.739611
H -2.461150 1.968073 -0.255929
H -3.157943 -2.233082 0.608508
H 0.040184 1.610776 0.002885
H -0.645378 -2.596813 0.827466
H 3.424783 -2.943257 0.105015
H 4.241717 -2.145036 -1.293995
H 4.588648 2.061896 0.307121
H 3.532696 2.551071 -1.076226
H 5.890880 -3.534518 0.071609
H 6.312289 -1.793256 0.127015
H 5.493821 -2.562372 1.523248
H 4.017633 4.526259 0.465992
H 2.270587 4.128724 0.453074
H 3.294315 3.622496 1.833564
H -5.898597 -0.987494 -1.762908
H -5.270404 0.514925 -2.335040


