%chk=000101495.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101495

0 1
 S   -2.585000     -0.3035000       1.365500    
 P    1.566700     -1.3300000E-02  0.4350000    
 O    2.787900     -1.5100000E-02   1.327200    
 N    1.562500      -1.279700     -0.6476000    
 N    1.448400       1.338800     -0.5299000    
 N   6.8599999E-02 -0.1353000       1.127900    
 N   -1.290100      0.1977000     -0.7884000    
 N   -2.627500      0.2116000      -1.144200    
 C    1.657300      -2.613800     -7.5900003E-02
 C    2.816800      -1.999700     -0.8044000    
 C    1.429000       2.620400      0.1586000    
 C    2.634600       2.176800     -0.6174000    
 C   -1.176100     -5.5799998E-02  0.4672000    
 C   -3.409200     -3.5399999E-02 -0.1148000    
 C   -4.884000     -9.3699999E-02 -0.1590000    
 H    1.087800      -3.381700     -0.5809000    
 H    1.712600      -2.696800       1.000800    
 H    3.679500      -1.689500     -0.2335000    
 H    3.029600      -2.353300      -1.804600    
 H    1.480200       2.610200       1.238600    
 H   0.7924000       3.377100     -0.2782000    
 H    2.812000       2.634800      -1.581400    
 H    3.522300       1.890700     -7.2499998E-02
 H  -3.8999999E-03 -0.3441000       2.122300    
 H   -5.247500      -1.081600      0.1418000    
 H   -5.327100      0.6582000      0.5018000    
 H   -5.245900      9.9900000E-02  -1.174000    


%chk=000101495-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101495

0 1
S -2.618745 -0.544547 1.683081
P 1.826059 -0.278075 0.742457
O 2.797902 -0.670671 1.950603
N 1.638184 -1.414532 -0.614888
N 2.252397 1.177100 -0.105980
N 0.182080 -0.291516 1.487882
N -1.188914 0.700138 -0.216239
N -2.531643 0.845855 -0.600574
C 2.075240 -2.849320 -0.387374
C 2.897519 -1.939486 -1.281622
C 1.535669 1.883921 -1.223480
C 1.738614 2.563872 0.127763
C -1.033833 0.008750 0.917596
C -3.407219 0.303769 0.231841
C -4.894461 0.349078 0.067161
H 1.404512 -3.591156 -0.829387
H 2.500514 -3.102579 0.592216
H 3.867349 -1.599058 -0.898809
H 2.817162 -2.019964 -2.369406
H 0.516349 1.554608 -1.453346
H 2.189230 2.143781 -2.062377
H 2.514881 3.323357 0.260035
H 0.843400 2.683039 0.750858
H 0.206705 -0.608909 2.460545
H -5.326058 -0.665119 -0.010020
H -5.381748 0.859019 0.917860
H -5.129245 0.902545 -0.856398


