%chk=000040787.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040787

0 1
 S   0.3176000       1.609700       0.000000    
 N  -8.5900001E-02 -0.9437000      9.9999997E-05
 C   -2.160800      0.4020000     -9.9999997E-05
 C  -0.6512000      0.2175000      9.9999997E-05
 C   -2.801000     -0.1811000       1.261800    
 C   -2.801000     -0.1813000      -1.261900    
 C    1.689500      0.5805000      9.9999997E-05
 C    1.279800     -0.7364000       0.000000    
 C    3.050400       1.153500     -1.9999999E-04
 C    2.162700      -1.920700       0.000000    
 H   -2.392500       1.476200     -1.9999999E-04
 H   -2.645400      -1.264000       1.324300    
 H   -3.879700      7.1000000E-03   1.274000    
 H   -2.369300      0.2691000       2.162600    
 H   -2.369200      0.2687000      -2.162700    
 H   -3.879700      6.8000001E-03  -1.274100    
 H   -2.645300      -1.264200      -1.324200    
 H    3.213300       1.770500     -0.8902000    
 H    3.211000       1.777200      0.8856000    
 H    3.818200      0.3735000      3.8000001E-03
 H    2.801000      -1.927000      0.8893000    
 H    1.580400      -2.847800     -1.1000000E-03
 H    2.802500      -1.926000     -0.8882000    


%chk=000040787-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040787

0 1
S 0.346806 1.762319 0.000260
N -0.088571 -0.859377 0.000164
C -2.258443 0.430052 -0.000122
C -0.753278 0.279909 -0.000055
C -2.864210 -0.206072 1.280335
C -2.864144 -0.206276 -1.280512
C 1.758289 0.622842 -0.000034
C 1.311738 -0.695273 0.000168
C 3.168945 1.141331 -0.000459
C 2.192627 -1.924292 0.000320
H -2.495570 1.511944 -0.000209
H -2.620797 -1.282000 1.318459
H -3.963620 -0.090603 1.280502
H -2.463235 0.270285 2.192704
H -2.463114 0.269934 -2.192933
H -3.963554 -0.090804 -1.280762
H -2.620731 -1.282210 -1.318452
H 3.381821 1.758861 -0.893160
H 3.380698 1.763376 0.889337
H 3.881498 0.298859 0.002128
H 2.843690 -1.966348 0.892886
H 1.553275 -2.820911 -0.000657
H 2.845278 -1.965449 -0.891111


