%chk=000150879.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150879

0 1
 S   -4.419500      -1.782700      3.8999999E-03
 O   -3.049900       2.034700     -0.7269000    
 O   -1.185100     -0.9589000       1.637800    
 O   -1.951600       3.628200      0.4413000    
 O    4.815700      -1.458800      0.1960000    
 N   -1.222700      0.1956000     -0.3742000    
 N  -0.5621000      -3.084000     -0.2302000    
 C  -0.8652000       1.484000      0.1706000    
 C   0.4225000       2.017400     -0.4705000    
 C    1.598400       1.087400     -0.2922000    
 C   -1.703300      -2.179700     -0.3914000    
 C   -1.354200     -0.9346000      0.4200000    
 C   -1.992400       2.489600     -1.3100000E-02
 C    2.410900       1.226500      0.8214000    
 C    1.843100      0.1122000      -1.245600    
 C   -2.968400      -2.878200      0.1132000    
 C    3.497500      0.3674000      0.9860000    
 C    2.929600     -0.7469000      -1.081000    
 C    3.756800     -0.6192000      3.4699999E-02
 H  -0.7245000       1.379900       1.253200    
 H   0.2632000       2.195500      -1.543400    
 H   0.6722000       3.002700     -5.4400001E-02
 H   -1.418200      0.1389000      -1.369400    
 H   -1.808900      -1.939900      -1.455800    
 H    2.215000       1.990300       1.568500    
 H    1.207200      4.8000002E-03  -2.119600    
 H   -2.863700      -3.177500       1.162200    
 H   -3.175300      -3.779300     -0.4743000    
 H    4.133600      0.4765000       1.860300    
 H    3.126000      -1.513900      -1.825100    
 H   0.2667000      -2.666600     -0.6530000    
 H  -0.7356000      -3.947900     -0.7427000    
 H   -3.748700       2.716500     -0.8222000    
 H   -4.386900      -1.616000      -1.326500    
 H    5.277400      -1.228800       1.020600    


%chk=000150879-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150879

0 1
S -1.854683 -1.673452 -2.600697
O -3.062043 1.646531 0.255922
O -1.982195 -0.888998 2.143353
O -1.920227 2.998551 1.761395
O 5.245547 -0.821864 -1.131992
N -1.035475 -0.174503 0.153982
N -2.816965 -3.243888 1.172987
C -0.704805 1.143474 0.689458
C 0.239366 1.917054 -0.285550
C 1.569014 1.210258 -0.499351
C -2.019955 -2.458948 0.235899
C -1.679043 -1.107857 0.926666
C -1.932745 2.015914 0.990355
C 2.557229 1.208620 0.516573
C 1.851131 0.525748 -1.710051
C -2.845500 -2.272659 -1.076528
C 3.788297 0.543099 0.338567
C 3.075751 -0.144282 -1.906676
C 4.044178 -0.136627 -0.877612
H -0.198230 1.021895 1.664867
H -0.283079 2.053951 -1.251551
H 0.396195 2.921355 0.148150
H -0.899181 -0.370100 -0.848207
H -1.055927 -2.952669 -0.028331
H 2.368993 1.739782 1.457827
H 1.106012 0.521610 -2.515637
H -3.639068 -1.520600 -0.939972
H -3.308207 -3.234223 -1.344195
H 4.542333 0.557778 1.136410
H 3.299450 -0.667711 -2.840830
H -2.923595 -2.788353 2.086621
H -2.646208 -4.248211 1.195160
H -3.816201 2.249664 0.498076
H -1.021522 -2.779284 -2.676706
H 5.860957 -0.755854 -0.360182


