%chk=000080513.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080513

0 1
 S  -5.4000001E-03  -1.228300       0.000000    
 O   -3.798100       1.433400      2.9500000E-02
 O    3.801500       1.434200     -2.9600000E-02
 N   -5.116000     -0.4796000     -1.9400001E-02
 N    5.115900     -0.4813000      1.9400001E-02
 N   -6.298300      0.2309000      1.5200000E-02
 N    6.299400      0.2269000     -1.5100000E-02
 C   -1.370400     -4.4399999E-02 -1.0800000E-02
 C    1.371000     -3.8899999E-02  1.0800000E-02
 C   -2.727700     -0.7393000     -2.1500001E-02
 C    2.727000     -0.7364000      2.1600001E-02
 C   -3.915700      0.2111000     -8.8999998E-03
 C    3.916900      0.2117000      8.8999998E-03
 H   -1.279700      0.5977000     -0.8938000    
 H   -1.292200      0.5959000      0.8747000    
 H    1.278700      0.6020000      0.8944000    
 H    1.291200      0.6001000     -0.8754000    
 H   -2.821200      -1.391500      0.8565000    
 H   -2.818600      -1.368400     -0.9164000    
 H    2.816200      -1.365700      0.9164000    
 H    2.818600      -1.388800     -0.8564000    
 H   -5.165000      -1.493200     -4.6399999E-02
 H    5.162800      -1.495100      4.6399999E-02
 H   -6.819000     -0.1008000      0.8260000    
 H   -6.838100     -5.3300001E-02 -0.8012000    
 H    6.819500     -0.1058000     -0.8260000    
 H    6.838700     -5.8300000E-02  0.8013000    


%chk=000080513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080513

0 1
S -0.000412 -1.517192 -0.002053
O -3.881210 0.886989 1.210349
O 3.883098 0.884851 -1.211519
N -5.066795 -0.341385 -0.364332
N 5.065122 -0.342599 0.366587
N -6.263774 0.415455 -0.249179
N 6.262030 0.414795 0.254402
C -1.426112 -0.274259 0.085300
C 1.426172 -0.275158 -0.087377
C -2.758534 -1.040769 0.151149
C 2.758149 -1.042496 -0.154224
C -3.926781 -0.074998 0.386713
C 3.927000 -0.076978 -0.387589
H -1.378964 0.370287 -0.809396
H -1.307023 0.347359 0.987358
H 1.379321 0.368121 0.808254
H 1.307613 0.347813 -0.988580
H -2.729099 -1.747776 1.003666
H -2.909500 -1.639643 -0.766971
H 2.908364 -1.643245 0.762783
H 2.728523 -1.747697 -1.008197
H -5.096451 -1.111441 -1.034386
H 5.093401 -1.112476 1.036902
H -6.625112 0.368940 0.714314
H -6.094957 1.395434 -0.518001
H 6.625991 0.368070 -0.708094
H 6.091940 1.394798 0.522322


