%chk=000001280.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001280

0 1
 S   -1.692400       1.745500      7.0400000E-02
 S    1.246200       1.425100      0.2137000    
 S    3.788200     -1.1500000E-02  9.8399997E-02
 O   -1.867800       2.048400       1.474800    
 O   -1.487500       2.761700     -0.9398000    
 O    4.100400       1.150500      0.9227000    
 O    4.196600      -1.347200      0.5150000    
 N   -1.324100      -2.776300      0.2935000    
 N    4.412900      0.2798000      -1.474900    
 C   -2.969800      0.5991000     -0.4848000    
 C   -1.465500      -1.492300     -0.3975000    
 C   -2.749500     -0.7996000      0.1217000    
 C  -0.2245000     -0.6615000     -0.1878000    
 C  -0.2740000      0.7040000      2.7000001E-03
 C   -4.347600       1.148300     -0.1328000    
 C    1.138900      -1.105100     -0.2117000    
 C    2.034600     -7.8699999E-02  3.7000000E-03
 C   -2.515200      -3.590300      0.1128000    
 H   -2.878300      0.5437000      -1.576500    
 H   -1.563900      -1.663300      -1.478500    
 H   -3.634800      -1.388600     -0.1441000    
 H   -2.725100     -0.7222000       1.217800    
 H   -4.486600       2.150000     -0.5532000    
 H   -5.137400      0.5033000     -0.5314000    
 H   -4.484500       1.221700      0.9513000    
 H    1.451000      -2.128800     -0.3759000    
 H  -0.5300000      -3.280700     -0.1015000    
 H   -2.279000      -4.621400      0.3992000    
 H   -2.854600      -3.620100     -0.9282000    
 H   -3.334200      -3.283700      0.7703000    
 H    4.303000     -0.4781000      -2.161000    
 H    4.226400       1.206300      -1.879600    


%chk=000001280-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000001280

0 1
S -1.873546 1.938855 0.326718
S 1.264032 1.455286 0.108899
S 3.608140 -0.667154 -0.339928
O -2.240539 2.030723 1.918623
O -1.614471 3.305228 -0.530647
O 4.425788 -0.100198 0.940741
O 3.621789 -2.245980 -0.745785
N -1.787597 -2.604218 0.643282
N 4.143065 0.397388 -1.730028
C -3.229340 0.771593 -0.535013
C -1.810836 -1.401251 -0.204353
C -3.076639 -0.582226 0.167197
C -0.511859 -0.569528 -0.149228
C -0.410568 0.798337 0.081097
C -4.575421 1.464786 -0.348753
C 0.802814 -1.146619 -0.338993
C 1.814096 -0.215249 -0.223030
C -1.197586 -3.858137 0.152778
H -2.874707 0.781510 -1.580960
H -1.922738 -1.753904 -1.250904
H -3.956114 -1.209103 -0.069688
H -3.102945 -0.413788 1.263408
H -4.583572 2.467050 -0.810529
H -5.366390 0.858277 -0.827934
H -4.819932 1.567959 0.723314
H 1.001878 -2.198366 -0.551486
H -1.617836 -2.404677 1.634367
H -1.559367 -4.697433 0.773350
H -0.084876 -3.902012 0.153549
H -1.543268 -4.043437 -0.880893
H 4.045492 -0.105095 -2.627022
H 5.104952 0.719385 -1.533347


