%chk=000030757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030757

0 1
 S  -0.7964000       1.223000      -1.883400    
 N    1.568800      0.1847000      0.2870000    
 C   0.3633000      0.4701000       1.070600    
 C   0.1632000       1.976200       1.317500    
 C   0.1875000       2.907600      0.1025000    
 C  -0.8741000     -0.2325000      0.5339000    
 C  -0.9649000       2.723100     -0.8743000    
 C   -1.441200      1.8700000E-02 -0.7304000    
 C   -1.473400      -1.213800       1.350200    
 C    1.816300      -1.254900      0.2424000    
 C    2.719400      0.8867000      0.8516000    
 C   -2.562800     -0.7164000      -1.151800    
 C   -2.593700      -1.928500      0.9267000    
 C   -3.137100      -1.681300     -0.3265000    
 C    3.020100      -1.555500     -0.5387000    
 C    4.005300      -1.807200      -1.177200    
 H   0.5337000      6.4199999E-02   2.080600    
 H   0.9060000       2.338500       2.040400    
 H  -0.7994000       2.117800       1.830100    
 H   0.1220000       3.933700      0.4889000    
 H    1.140900       2.861900     -0.4338000    
 H   -1.931600       2.732000     -0.3591000    
 H  -0.9703000       3.568600      -1.570900    
 H   -1.064200      -1.436700       2.333400    
 H    1.925700      -1.673800       1.251300    
 H   0.9917000      -1.788700     -0.2429000    
 H    2.913000      0.5897000       1.889900    
 H    2.632400       1.975100      0.8233000    
 H    3.635900      0.7024000      0.2806000    
 H   -3.008300     -0.5423000      -2.129400    
 H   -3.035700      -2.679900       1.574200    
 H   -4.006300      -2.238000     -0.6636000    
 H    4.879200      -2.029800      -1.743500    


%chk=000030757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030757

0 1
S -0.796685 1.120192 -1.954550
N 1.593634 0.276520 0.416566
C 0.322822 0.530286 1.168235
C 0.071244 2.064249 1.327691
C 0.252032 2.924191 0.056959
C -0.887005 -0.231013 0.604827
C -0.847900 2.758656 -1.000812
C -1.446617 -0.056540 -0.695968
C -1.498438 -1.189628 1.457790
C 1.772011 -1.158417 0.057306
C 2.771380 0.807279 1.139295
C -2.542827 -0.852133 -1.114571
C -2.594823 -1.977742 1.046065
C -3.113001 -1.817891 -0.257599
C 2.958265 -1.404056 -0.783691
C 3.943946 -1.661308 -1.478058
H 0.444497 0.141927 2.216185
H 0.757626 2.447793 2.106844
H -0.952181 2.196598 1.731043
H 0.268727 3.992373 0.360458
H 1.228257 2.696094 -0.408345
H -1.858895 2.852819 -0.567035
H -0.737842 3.512422 -1.800809
H -1.087232 -1.326975 2.465588
H 1.848979 -1.811619 0.966872
H 0.875699 -1.488803 -0.495839
H 2.871947 0.388275 2.173971
H 2.715472 1.905475 1.217576
H 3.683297 0.555626 0.573403
H -2.953982 -0.692527 -2.116831
H -3.033861 -2.709297 1.733058
H -3.960253 -2.421719 -0.600624
H 4.796705 -1.876408 -2.095400


