%chk=000129941.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129941

0 1
 S    2.460100      0.7014000       1.280900    
 O    4.340500     -0.5939000      5.0999999E-02
 N   0.8728000      -1.095500     -0.5784000    
 N    2.223100      -1.153100     -0.6243000    
 N   -4.008500     -0.1394000      0.1227000    
 C   0.9956000       1.203400      0.3524000    
 C   0.2708000     -5.1300000E-02 -9.5100001E-02
 C   -1.225900     -8.2000002E-02 -1.7999999E-02
 C    1.368500       2.090700     -0.8312000    
 C   -1.948000       1.092500     -0.1622000    
 C   -1.880700      -1.284900      0.1959000    
 C    3.125600     -0.4385000      0.1329000    
 C   -3.328900       1.010800     -8.4399998E-02
 C   -3.264800      -1.260200      0.2578000    
 H   0.3716000       1.771900       1.048600    
 H    1.883700       2.998100     -0.4972000    
 H    2.014000       1.577600      -1.552600    
 H   0.4793000       2.406200      -1.385800    
 H   -1.489800       2.057300     -0.3369000    
 H   -1.350500      -2.222600      0.3206000    
 H    2.573300      -1.889100      -1.230100    
 H   -3.945000       1.897600     -0.1917000    
 H   -3.829600      -2.171400      0.4249000    


%chk=000129941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129941

0 1
S 2.587359 0.975629 1.258405
O 4.435320 -0.802216 0.301198
N 0.875228 -1.106277 -0.412813
N 2.267269 -1.155610 -0.462793
N -4.079353 -0.176929 0.124811
C 1.010241 1.316743 0.226380
C 0.272891 0.011621 -0.027715
C -1.211680 -0.041234 0.033616
C 1.357601 2.050107 -1.086383
C -2.006353 1.131061 0.155848
C -1.899357 -1.285704 -0.041528
C 3.236272 -0.444203 0.268798
C -3.413816 1.012710 0.195896
C -3.306440 -1.302333 0.004808
H 0.428429 1.973108 0.892326
H 1.906156 2.982484 -0.869649
H 1.986735 1.424619 -1.742659
H 0.433534 2.304879 -1.638724
H -1.560527 2.129207 0.210474
H -1.328689 -2.213187 -0.130969
H 2.614304 -2.014709 -0.899388
H -4.043096 1.905065 0.288907
H -3.854828 -2.249230 -0.049046


