%chk=000123648.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123648

0 1
 S    4.054300     -0.5771000      4.9999999E-03
 O   -1.453300      -2.008200      -1.187200    
 O   -1.537000      -2.065500       1.073500    
 O   -1.890800       2.459400     -1.1200000E-02
 O   -2.582600      0.3763000      2.4800001E-02
 N   -1.662300       1.227000      7.0000002E-03
 C  -4.4999998E-03 -0.5819000      2.6900001E-02
 C  -0.3121000      0.7785000      7.1999999E-03
 C    1.327600     -0.9957000      2.6400000E-02
 C   0.7125000       1.725000     -1.2900000E-02
 C    2.352100     -4.9300000E-02  6.0000001E-03
 C    2.044500       1.311100     -1.3700000E-02
 C   -1.048300      -1.599700      4.8400000E-02
 H    1.561200      -2.058500      4.1900001E-02
 H   0.5147000       2.793800     -2.8600000E-02
 H    2.826400       2.066400     -2.9800000E-02
 H    4.614600      0.6414000     -1.4700000E-02
 H   -2.155100      -2.691400      -1.133000    


%chk=000123648-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123648

0 1
S 4.113003 -0.612211 0.205923
O -1.807619 -1.627835 -1.146385
O -1.042063 -2.693421 0.777922
O -1.974527 2.394570 -0.466858
O -2.569879 0.447169 0.569071
N -1.704276 1.222837 0.005210
C 0.014354 -0.620352 0.031142
C -0.303259 0.759394 -0.059124
C 1.369827 -0.996260 0.118327
C 0.709359 1.739019 -0.115916
C 2.396324 -0.018101 0.082852
C 2.059317 1.352420 -0.050707
C -0.999504 -1.730839 -0.015972
H 1.614710 -2.059627 0.204114
H 0.423671 2.791441 -0.192753
H 2.839377 2.120269 -0.086873
H 4.721356 0.627478 0.110637
H -2.498270 -2.344351 -1.134611


