%chk=000038235.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038235

0 1
 S   -1.268400       2.297300     -0.7793000    
 O    1.256100      0.2045000      0.2308000    
 O    2.602400      -1.561200     -0.3805000    
 N   0.2316000     -0.7237000      1.5400000E-02
 N    3.477800      0.5096000      0.1846000    
 C   -2.187700      -1.119900      8.9999996E-03
 C  -0.9460000     -0.2158000      0.2410000    
 C   -3.008100      -1.274100       1.297300    
 C   -3.051500     -0.4884000      -1.092900    
 C   -1.764800      -2.529100     -0.4528000    
 C   -1.161000       1.227100      0.6786000    
 C   -1.514400       3.876000      6.6799998E-02
 C    2.458000     -0.3958000     -2.4200000E-02
 C    4.875900      0.1933000      6.3000000E-03
 H   -3.821800      -1.996600       1.167000    
 H   -2.376500      -1.620800       2.123100    
 H   -3.465000     -0.3303000       1.610900    
 H   -2.464700     -0.2804000      -1.994500    
 H   -3.524900      0.4416000     -0.7628000    
 H   -3.865300      -1.163900      -1.382600    
 H   -2.637300      -3.168500     -0.6305000    
 H   -1.192000      -2.489100      -1.386600    
 H   -1.139900      -3.024400      0.2996000    
 H   -2.087200       1.311000       1.249900    
 H  -0.3454000       1.555700       1.328700    
 H  -0.6617000       4.098600      0.7135000    
 H   -2.431400       3.850700      0.6612000    
 H   -1.604100       4.672800     -0.6764000    
 H    3.232700       1.448500      0.4838000    
 H    5.378700      0.3169000      0.9685000    
 H    5.296100      0.8991000     -0.7142000    
 H    5.010900     -0.8292000     -0.3538000    


%chk=000038235-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038235

0 1
S -0.481959 2.507608 -0.397446
O 1.376216 0.074349 0.319167
O 2.854807 -1.792368 0.015211
N 0.242781 -0.835646 0.015812
N 3.588219 0.445345 0.097658
C -2.175215 -1.015076 0.019320
C -0.885762 -0.220295 0.302018
C -2.893256 -1.293451 1.375606
C -3.103505 -0.171214 -0.902874
C -1.867299 -2.367709 -0.673730
C -0.956262 1.168921 0.894851
C -1.950970 3.668587 -0.179144
C 2.654441 -0.567338 0.116514
C 5.023089 0.171481 -0.007774
H -3.828261 -1.853406 1.189194
H -2.253723 -1.902390 2.039389
H -3.160636 -0.362214 1.908776
H -2.608284 0.055033 -1.863396
H -3.398841 0.785907 -0.435111
H -4.027332 -0.742098 -1.111063
H -2.815123 -2.910066 -0.850435
H -1.361240 -2.214363 -1.641980
H -1.206805 -2.997747 -0.055262
H -1.973566 1.406898 1.238638
H -0.242728 1.272209 1.727491
H -1.994574 4.054449 0.851731
H -2.891761 3.158665 -0.442608
H -1.784254 4.506294 -0.875174
H 3.242330 1.404772 0.139334
H 5.573283 0.561291 0.868712
H 5.450363 0.616128 -0.925723
H 5.156925 -0.921054 -0.052804


