%chk=000091729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091729

0 1
 S   -2.483600     -0.2635000       1.680900    
 S   -4.001600       1.155900      -2.014000    
 O   -2.310400      0.7616000       2.690900    
 O   -3.460200      -1.323800       1.829500    
 O   0.1683000       1.025700      0.7944000    
 O   -4.567000      -1.681800      -2.082100    
 O   -2.805200      -2.290300     -0.7812000    
 O    4.363200       2.235200     -0.5510000    
 N  -0.9668000     -0.9412000       1.285200    
 N    1.268200      -1.028100      0.6319000    
 N    3.435600      -1.670000      3.5500001E-02
 N    2.794200      0.6423000      4.3800000E-02
 N    5.027200      1.8800000E-02 -0.5747000    
 C   -3.074300      0.6081000      0.2833000    
 C   -3.492400      9.9999997E-05 -0.8578000    
 C   -3.153400       2.012300      0.2546000    
 C   -3.648300       2.452700     -0.9532000    
 C   0.1920000     -0.1956000      0.8858000    
 C   -3.558000      -1.384500      -1.202000    
 C    2.570000     -0.6656000      0.2146000    
 C    4.648400      -1.251500     -0.3607000    
 C    4.048500      0.9110000     -0.3529000    
 C    5.679600      -2.304600     -0.5852000    
 C    3.326000       3.176600     -0.3156000    
 H   -2.871600       2.690300       1.049700    
 H  -0.8949000      -1.966300       1.303100    
 H   -3.818500       3.473900      -1.263700    
 H    1.125500      -2.026800      0.7535000    
 H    6.226200      -2.490200      0.3441000    
 H    5.215000      -3.240200     -0.9119000    
 H    6.392300      -1.993300      -1.355300    
 H   -4.587300      -2.638300      -2.299000    
 H    2.997200       3.147600      0.7287000    
 H    2.482300       3.011300     -0.9942000    
 H    3.725800       4.175500     -0.5142000    


%chk=000091729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091729

0 1
S -2.598597 -0.558000 1.843565
S -3.948314 1.800998 -1.719434
O -2.379132 0.317848 3.180704
O -3.582189 -1.839574 1.843800
O 0.037835 0.873397 1.132264
O -3.703657 -0.918948 -2.826499
O -2.526009 -1.934549 -1.095784
O 4.101113 1.982035 -1.290008
N -0.989178 -1.244175 1.278769
N 1.277051 -1.149068 0.858352
N 3.494763 -1.675128 0.422562
N 2.615889 0.489936 -0.250853
N 4.946448 -0.078415 -0.686149
C -3.092492 0.659826 0.480498
C -3.358400 0.330948 -0.845744
C -3.320159 2.018079 0.850153
C -3.781787 2.766035 -0.224144
C 0.110829 -0.375564 1.076794
C -3.146986 -0.938638 -1.547996
C 2.499731 -0.735325 0.325124
C 4.703055 -1.294800 -0.107465
C 3.868470 0.761696 -0.720409
C 5.844863 -2.268005 -0.019961
C 2.958987 2.931432 -1.331676
H -3.134085 2.399606 1.855390
H -1.156766 -2.067594 0.680609
H -4.033419 3.824943 -0.248659
H 1.288105 -2.113104 1.205073
H 6.399835 -2.107436 0.923879
H 5.470864 -3.303532 -0.017683
H 6.547187 -2.106125 -0.851909
H -3.529417 -1.784130 -3.284493
H 2.544473 3.081970 -0.321940
H 2.165435 2.542109 -1.990610
H 3.397654 3.854551 -1.735320


