%chk=000088180.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088180

0 1
 S    1.883200     -0.6889000      0.4190000    
 O   -1.800600      -1.307200      0.8390000    
 O   -1.409800     -0.7051000      -1.312900    
 N   -1.263800       1.901300      4.7499999E-02
 C  -0.5275000      0.7003000      0.4465000    
 C   0.9138000      0.7767000     -6.0600001E-02
 C   -1.270600     -0.4983000     -0.1131000    
 C    3.475300     -0.1787000     -0.2653000    
 H  -0.5367000      0.6429000       1.541500    
 H   0.9350000      0.8497000      -1.154200    
 H    1.406500       1.665100      0.3505000    
 H   -1.225300       2.009000     -0.9659000    
 H  -0.8018000       2.725600      0.4308000    
 H    3.396700     -3.0500000E-02  -1.345500    
 H    4.216000     -0.9603000     -7.5700000E-02
 H    3.817000      0.7447000      0.2095000    
 H   -2.287400      -2.063400      0.4471000    


%chk=000088180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088180

0 1
S 2.304232 0.115233 1.115343
O -1.555913 -1.185281 0.500401
O -0.144801 -0.765590 -1.297506
N -1.272901 1.959843 0.002554
C -0.358612 0.927138 0.527512
C 1.103480 1.370935 0.353991
C -0.607100 -0.415523 -0.184734
C 3.041885 -0.641908 -0.448168
H -0.576869 0.787060 1.598864
H 1.361051 1.475276 -0.714093
H 1.253870 2.334883 0.862949
H -1.198650 2.124945 -1.005943
H -2.238774 1.896846 0.334122
H 2.231383 -0.981149 -1.110845
H 3.646759 -1.500518 -0.116273
H 3.686402 0.090903 -0.958439
H -1.755443 -2.010192 -0.021534


