%chk=000005455.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005455

0 1
 S  -0.5071000      0.9486000       1.144300    
 S   0.4415000       1.076800     -0.6826000    
 S   -1.894300      -1.630300       1.678300    
 S    1.208200      -1.768900      -1.099800    
 N   -2.729500      0.1903000     -0.2192000    
 N    2.896500      0.1259000     -1.6600000E-02
 C   -3.462600     -0.7492000      -1.073400    
 C   -3.015500       1.595800     -0.5176000    
 C    3.988600     -0.8409000      0.1227000    
 C    3.250900       1.476000      0.4317000    
 C   -1.817800     -0.1963000      0.7841000    
 C    1.641300     -0.2279000     -0.5519000    
 H   -3.093700      -1.769900     -0.9534000    
 H   -3.333000     -0.4538000      -2.119000    
 H   -4.522600     -0.7109000     -0.8069000    
 H   -2.692300       2.266000      0.2813000    
 H   -4.097700       1.717200     -0.6316000    
 H   -2.526500       1.866900      -1.457400    
 H    3.690400      -1.873500     -5.7000000E-02
 H    4.384100     -0.7752000       1.141600    
 H    4.776500     -0.5744000     -0.5886000    
 H    4.329400       1.630700      0.3255000    
 H    2.975700       1.569200       1.486200    
 H    2.748700       2.251400     -0.1489000    


%chk=000005455-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005455

0 1
S -0.546770 1.827405 1.281593
S 0.630336 2.309642 -0.835698
S -1.941578 -0.311750 2.689892
S 2.096755 0.900771 -2.942028
N -2.361055 0.098435 0.001393
N 2.575624 0.359330 -0.288120
C -3.203895 -1.117748 -0.045180
C -2.399994 0.948251 -1.210406
C 3.482363 -0.741364 -0.684402
C 2.616102 0.731770 1.144125
C -1.718708 0.433283 1.152488
C 1.878022 1.039031 -1.238740
H -2.839181 -1.850207 0.692098
H -3.150168 -1.548950 -1.059158
H -4.256026 -0.876102 0.196990
H -2.212843 1.998749 -0.942021
H -3.404895 0.866772 -1.659846
H -1.640068 0.639970 -1.950089
H 3.131782 -1.188440 -1.627955
H 3.486133 -1.503211 0.113487
H 4.511509 -0.366483 -0.840540
H 3.646705 0.586439 1.512605
H 1.920857 0.118703 1.744058
H 2.338191 1.789305 1.267256


