%chk=000108073.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108073

0 1
 S   0.6549000     -0.3746000      0.5782000    
 O   -2.686500      -2.006700       1.162500    
 O   -1.804300      -2.900300     -0.7253000    
 O   -3.228200       2.026700      -1.183800    
 O    5.766000      0.2611000      0.8327000    
 O    4.770000      0.6640000      -1.167900    
 N   -2.503000      0.4643000      0.3830000    
 C   -1.927000     -0.4860000     -0.5353000    
 C  -0.4629000     -0.1658000     -0.8474000    
 C    2.204500      4.4000000E-02 -0.2501000    
 C   -2.117800      -1.918100     -6.3600004E-02
 C    3.396600     -3.3000000E-02  0.6935000    
 C   -3.106800       1.644300     -2.2900000E-02
 C    4.690900      0.3405000      1.0600000E-02
 C   -3.646400       2.439600       1.135700    
 H   -2.500000     -0.4066000      -1.468400    
 H  -0.3747000      0.8660000      -1.205200    
 H  -0.1110000     -0.8311000      -1.643700    
 H    2.353600     -0.6429000      -1.090600    
 H    2.121400       1.056800     -0.6601000    
 H   -2.449000      0.2575000       1.376400    
 H    3.258200      0.6553000       1.535400    
 H    3.507200      -1.053100       1.079400    
 H   -3.944400       3.434300      0.7931000    
 H   -4.516500       1.927900       1.556000    
 H   -2.879700       2.550200       1.908000    
 H   -2.806500      -2.938500       1.444800    
 H    6.598500      0.4975000      0.3709000    


%chk=000108073-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108073

0 1
S 0.710016 1.078196 0.244004
O -1.717363 -1.868082 1.251110
O -0.397084 -2.243883 -0.620773
O -3.704294 1.704003 -1.105494
O 5.580250 -0.514710 1.038569
O 4.793278 -0.917585 -1.109670
N -2.526306 0.524455 0.501500
C -1.743111 -0.184022 -0.514104
C -0.582487 0.670576 -1.081623
C 2.169341 0.065997 -0.431385
C -1.203925 -1.518101 -0.003470
C 3.332207 0.189878 0.562087
C -3.492121 1.442121 0.120132
C 4.595105 -0.470186 0.040111
C -4.265986 2.105115 1.252017
H -2.423345 -0.395855 -1.367990
H -0.993517 1.616351 -1.465064
H -0.072224 0.130085 -1.894839
H 1.843730 -0.979513 -0.550857
H 2.450822 0.471847 -1.415951
H -2.384155 0.276509 1.481161
H 3.568556 1.254361 0.761004
H 3.079807 -0.255287 1.541860
H -4.112614 3.196984 1.203500
H -5.344212 1.920645 1.106714
H -3.971887 1.747773 2.253618
H -1.336443 -2.743366 1.532841
H 6.405062 -0.931005 0.666893


