%chk=000095092.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095092

0 1
 S  -0.4293000     -0.6223000     -0.5955000    
 O    2.681300       3.130000      0.2967000    
 N    2.422600      -2.132600     -0.2872000    
 N    3.652200       1.068300      0.2429000    
 N    4.440000      -1.258300      0.1313000    
 N    1.267000       1.369100     -0.1141000    
 C    2.241500     -0.7856000     -0.1777000    
 C    3.489000     -0.2863000      7.6600000E-02
 C    1.122900      8.7200001E-02 -0.2696000    
 C   -1.483200      0.5669000      0.2634000    
 C   -2.941000      0.2124000      0.1589000    
 C    3.763000      -2.368300     -9.3000002E-02
 C    2.531800       1.914800      0.1478000    
 C   -3.518300     -0.6032000       1.123300    
 C   -3.691800      0.7053000     -0.9004000    
 C   -4.870500     -0.9320000       1.026700    
 C   -5.044000      0.3766000     -0.9968000    
 C   -5.633200     -0.4421000     -3.3300001E-02
 H   -1.331300       1.570000     -0.1527000    
 H   -1.189200      0.6197000       1.318700    
 H    1.712000      -2.827700     -0.4743000    
 H    4.578900       1.435300      0.4314000    
 H    4.174900      -3.366800     -0.1287000    
 H   -2.933600     -0.9911000       1.952800    
 H   -3.243200       1.342800      -1.657300    
 H   -5.329300      -1.569600       1.776700    
 H   -5.638000      0.7577000      -1.822300    
 H   -6.686000     -0.6981000     -0.1085000    


%chk=000095092-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095092

0 1
S -0.236360 -1.164352 1.584524
O 1.395661 2.991849 -0.908761
N 2.619058 -2.214039 0.141956
N 2.757699 1.101909 -1.078680
N 4.064198 -1.018790 -1.163165
N 0.703275 1.035900 0.217073
C 2.077798 -0.922398 0.037648
C 2.995498 -0.217757 -0.773247
C 0.919617 -0.243746 0.526537
C -1.584327 0.183777 1.902306
C -2.739299 0.107165 0.938643
C 3.799276 -2.218811 -0.588683
C 1.585485 1.787369 -0.595744
C -3.869183 -0.704445 1.221060
C -2.717089 0.868848 -0.260096
C -4.956279 -0.759823 0.321485
C -3.805055 0.813525 -1.158593
C -4.926026 -0.001035 -0.872286
H -1.025061 1.129266 1.816198
H -1.876042 -0.008579 2.946700
H 2.212780 -2.995769 0.654858
H 3.403655 1.634992 -1.666326
H 4.432987 -3.097301 -0.682935
H -3.897271 -1.291517 2.147902
H -1.843955 1.494996 -0.475087
H -5.825287 -1.386799 0.550958
H -3.780536 1.408695 -2.078254
H -5.770016 -0.041029 -1.570187


