%chk=000099449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099449

0 1
 S  -9.7400002E-02   1.145200      -1.184700    
 N    1.462500      -1.004900      -1.022200    
 N    3.274200      0.1388000      0.7879000    
 C   -1.464000      8.1400000E-02 -0.6103000    
 C   -1.415600     -5.9099998E-02  0.9141000    
 C   -2.806200      0.6522000      -1.078000    
 C   -2.585800     -0.8980000       1.427600    
 C   -3.973000     -0.1884000     -0.5597000    
 C   -3.927000     -0.3417000      0.9579000    
 C    1.321400      0.2518000     -0.5640000    
 C    2.206100      0.8167000      0.3229000    
 C    2.053800       2.209800      0.8340000    
 C    2.530600      -1.682800     -0.5573000    
 C    3.420400      -1.121100      0.3318000    
 H   -1.332200     -0.9076000      -1.066400    
 H   -1.453800      0.9288000       1.392100    
 H  -0.4908000     -0.5433000       1.245800    
 H   -2.848900      0.6821000      -2.173800    
 H   -2.929400       1.683400     -0.7215000    
 H   -2.563900     -0.9294000       2.522800    
 H   -2.475800      -1.931300       1.075800    
 H   -3.944000      -1.180100      -1.027800    
 H   -4.920800      0.2761000     -0.8545000    
 H   -4.736100      -1.003700       1.286300    
 H   -4.101400      0.6339000       1.428100    
 H    2.864400       2.460300       1.527400    
 H    2.092900       2.933000      1.3300000E-02
 H    1.112100       2.323700       1.380400    
 H    2.648600      -2.695300     -0.9231000    
 H    4.278200      -1.666600      0.7050000    


%chk=000099449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099449

0 1
S -0.135634 1.485475 -0.024638
N 1.201388 -0.929195 0.017180
N 3.762605 0.283298 0.153724
C -1.542271 0.182588 -0.090098
C -1.860326 -0.355698 1.317734
C -2.763013 0.849714 -0.754951
C -3.053995 -1.344402 1.257644
C -3.954212 -0.142679 -0.804240
C -4.294409 -0.692204 0.601527
C 1.344285 0.421192 0.042661
C 2.636935 1.051339 0.109396
C 2.796605 2.550148 0.129053
C 2.342028 -1.680581 0.059241
C 3.614391 -1.079519 0.129454
H -1.137514 -0.631338 -0.717948
H -2.113229 0.492137 1.985453
H -0.966888 -0.854871 1.733162
H -2.503267 1.192052 -1.774080
H -3.060699 1.745926 -0.172815
H -3.295075 -1.694840 2.279630
H -2.758542 -2.239972 0.673080
H -3.697907 -0.988267 -1.475326
H -4.834899 0.361302 -1.246816
H -5.122297 -1.424299 0.534280
H -4.651892 0.140106 1.242664
H 3.865910 2.801150 0.198930
H 2.374522 3.008874 -0.785524
H 2.258806 2.999069 0.985675
H 2.215999 -2.767851 0.037785
H 4.531696 -1.674753 0.168059


