%chk=000029882.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029882

0 1
 S    2.194900     -0.5580000     -0.7387000    
 S   -1.620300      -2.141800     -0.4450000    
 N  -0.1129000       1.668100     -0.2110000    
 C  -0.3508000      0.2772000      0.1992000    
 C   0.9848000     -0.3703000      0.6099000    
 C   -1.143100     -0.4469000     -0.9033000    
 C   0.5675000       2.398400      0.8546000    
 C   -1.375400       2.314900     -0.5563000    
 C    3.492600      -1.397800      0.1963000    
 C   -2.637300      -1.743800      0.9944000    
 H  -0.9711000      0.3059000       1.104800    
 H    1.457400      0.1356000       1.457100    
 H   0.7781000      -1.380400      0.9819000    
 H   -2.094900      3.4899998E-02  -1.138600    
 H  -0.5742000     -0.4967000      -1.837800    
 H    1.623600       2.126400      0.9412000    
 H   7.7799998E-02   2.284300       1.828800    
 H   0.5892000       3.471900      0.6278000    
 H   -1.234700       3.398000     -0.6639000    
 H   -2.154100       2.164700      0.2005000    
 H   -1.744000       1.999300      -1.537300    
 H    3.840700     -0.7665000       1.017900    
 H    4.338200      -1.602400     -0.4657000    
 H    3.124700      -2.348200      0.5918000    
 H   -2.013900      -1.503100       1.858800    
 H   -3.236100      -2.621800       1.252800    
 H   -3.321200     -0.9182000      0.7807000    


%chk=000029882-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029882

0 1
S 2.370289 -0.161206 -0.588983
S -1.379009 -2.300672 -0.099512
N -0.189239 1.732555 -0.144206
C -0.286773 0.329031 0.354301
C 1.073417 -0.243888 0.799208
C -0.911076 -0.581797 -0.735543
C 0.694837 2.609521 0.659247
C -1.511874 2.372145 -0.330507
C 3.525140 -1.494096 0.076009
C -2.976199 -1.878453 0.808236
H -0.943514 0.288260 1.268365
H 1.470815 0.283714 1.681871
H 0.924243 -1.308775 1.050688
H -1.821647 -0.146074 -1.174476
H -0.175242 -0.754027 -1.538493
H 1.731112 2.235275 0.638507
H 0.365439 2.716804 1.724174
H 0.699190 3.615782 0.204079
H -1.366428 3.390601 -0.730690
H -2.094498 2.456261 0.623128
H -2.127125 1.819449 -1.058816
H 3.914321 -1.212099 1.067861
H 4.361554 -1.569457 -0.636491
H 2.999441 -2.460976 0.133422
H -2.783092 -1.195942 1.651069
H -3.379019 -2.829993 1.189343
H -3.699562 -1.428244 0.109110


