%chk=000025118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025118

0 1
 S    1.993600      -2.334900      0.1889000    
 N   -3.678300      9.0499997E-02  1.8600000E-02
 C   -1.416000     -0.5051000     -0.8002000    
 C  -3.5599999E-02 -0.8980000     -0.4199000    
 C   -2.321600     -0.2677000      0.4183000    
 C    1.033300      3.4200002E-02 -0.1994000    
 C    2.216900     -0.6256000      0.1456000    
 C   0.3499000      -2.205600     -0.2433000    
 C    1.053400       1.447800     -0.2781000    
 C   -3.677400       1.341400     -0.7414000    
 C   -4.546100      0.2088000       1.191300    
 C    3.405000      8.3400004E-02  0.4108000    
 C    2.230400       2.153900     -1.6100001E-02
 C    3.392600       1.476900      0.3251000    
 H   -1.350700      0.3843000      -1.435400    
 H   -1.857100      -1.289100      -1.431100    
 H   -1.883400      0.5035000       1.066700    
 H   -2.349600      -1.192800       1.009800    
 H  -0.2559000      -3.095300     -0.3464000    
 H   0.1548000       2.001200     -0.5394000    
 H   -3.148500       2.147800     -0.2204000    
 H   -4.705600       1.679400     -0.9199000    
 H   -3.245700       1.213200      -1.738400    
 H   -4.576400     -0.7360000       1.745500    
 H   -5.576700      0.4251000      0.8883000    
 H   -4.213300      0.9991000       1.873900    
 H    4.319500     -0.4382000      0.6783000    
 H    2.233000       3.238500     -7.8900002E-02
 H    4.302800       2.034700      0.5277000    


%chk=000025118-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025118

0 1
S 2.137842 -2.476534 0.113460
N -3.656354 0.188091 0.048614
C -1.425345 -0.575760 -0.856377
C -0.013201 -0.983982 -0.490579
C -2.242281 -0.107218 0.378475
C 1.060174 -0.034346 -0.198547
C 2.295621 -0.668744 0.148414
C 0.404632 -2.293015 -0.371406
C 1.018506 1.387335 -0.233274
C -3.820999 1.392477 -0.790533
C -4.501155 0.252949 1.259948
C 3.458260 0.064631 0.460079
C 2.174126 2.129175 0.073458
C 3.387814 1.473661 0.421390
H -1.387738 0.230696 -1.614105
H -1.968426 -1.421775 -1.314063
H -1.734433 0.771263 0.855657
H -2.232061 -0.923801 1.124153
H -0.179238 -3.198309 -0.535274
H 0.088198 1.899792 -0.502636
H -3.440047 2.325053 -0.298009
H -4.892281 1.539519 -1.015928
H -3.293500 1.271219 -1.751724
H -4.419016 -0.693933 1.822529
H -5.558478 0.385996 0.967994
H -4.226776 1.091169 1.950487
H 4.393393 -0.439933 0.723832
H 2.142004 3.223825 0.044936
H 4.278060 2.065900 0.659529


