%chk=000164524.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164524

0 1
 S  -0.5463000      -2.028400       1.607700    
 S  -0.7341000      -4.078800     -0.5564000    
 O    1.577300      -1.606200     -3.7400000E-02
 N   -2.044800      -1.624800     -0.6367000    
 N    1.425800     -0.2005000       1.733900    
 C   -1.633700      0.7820000     -0.4279000    
 C   -2.387800     -0.3650000     -0.1312000    
 C   -2.028700       2.029000      0.1124000    
 C   -3.515200     -0.2837000      0.6867000    
 C  -0.4960000      0.7188000      -1.249000    
 C   -3.166200       2.092200      0.9337000    
 C   -1.274300       3.175900     -0.1839000    
 C   -3.903600      0.9425000       1.218100    
 C   0.2416000       1.868300      -1.533100    
 C   -2.586200      -2.036600      -1.962800    
 C  -0.1468000       3.094600      -1.001600    
 C   -1.170400      -2.553600      2.0600000E-02
 C    2.631500     -0.7404000     -9.5899999E-02
 C    2.535500      0.1182000      0.9893000    
 C   0.9288000      -1.205500       1.074900    
 C    3.637300     -0.6968000      -1.053400    
 C    3.510900       1.111600       1.155800    
 C    4.602500      0.2999000     -0.8727000    
 C    4.542700       1.187200      0.2089000    
 H   -4.100700      -1.170600      0.9168000    
 H  -0.1667000     -0.2129000      -1.701200    
 H   -3.488200       3.040000       1.360100    
 H   -1.559200       4.144800      0.2208000    
 H   -4.781400       1.005200       1.854700    
 H    1.117700       1.806500      -2.172200    
 H   -3.223300      -1.244400      -2.368900    
 H   -3.184400      -2.944700      -1.843400    
 H   -1.758300      -2.215900      -2.655300    
 H   0.4280000       3.989000      -1.223300    
 H    3.673700      -1.387200      -1.886600    
 H    3.474000       1.804700       1.989700    
 H    5.416400      0.3875000      -1.588400    
 H    5.310100       1.949700      0.3173000    


%chk=000164524-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164524

0 1
S -0.504612 -2.922106 1.334298
S -2.078338 -4.522511 -0.717954
O 1.411367 -1.596217 -0.172361
N -1.982684 -1.790102 -0.771754
N 0.991727 -0.621186 1.901235
C -1.277284 0.613283 -0.674700
C -1.970676 -0.504628 -0.087440
C -1.387881 1.903248 -0.022130
C -2.713086 -0.357235 1.088196
C -0.486738 0.504229 -1.866144
C -2.142899 2.020136 1.190524
C -0.729621 3.035941 -0.606272
C -2.784301 0.909250 1.740565
C 0.140276 1.627144 -2.409373
C -2.772917 -1.855175 -2.033971
C 0.013249 2.906066 -1.780684
C -1.604498 -2.980625 -0.196355
C 2.317988 -0.523731 -0.002939
C 2.068831 0.063643 1.270527
C 0.643520 -1.568741 1.048211
C 3.312901 -0.082535 -0.882597
C 2.845979 1.156325 1.707587
C 4.089003 1.011127 -0.429703
C 3.858237 1.618986 0.838026
H -3.238850 -1.221482 1.505745
H -0.355741 -0.479583 -2.328373
H -2.209053 2.998303 1.680843
H -0.817602 4.009391 -0.109460
H -3.357567 1.001781 2.668529
H 0.746709 1.528693 -3.316263
H -2.873440 -0.836519 -2.436078
H -3.772240 -2.283078 -1.834818
H -2.262555 -2.507847 -2.761780
H 0.511881 3.777456 -2.218386
H 3.487618 -0.557098 -1.851537
H 2.665803 1.617208 2.682724
H 4.889891 1.396525 -1.069690
H 4.485100 2.463265 1.143850


