%chk=000097728.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097728

0 1
 S    2.423800      -1.462200     -6.1799999E-02
 S  -7.9300001E-02  -3.040000     -0.4102000    
 O   0.7891000       1.984100      3.7999999E-02
 N   0.1321000     -0.2743000     -0.1227000    
 C    2.458100      0.3138000     -0.3673000    
 C    3.462000       1.004400      0.5391000    
 C    1.043700      0.7934000     -0.1285000    
 C   0.6700000      -1.559300     -0.1770000    
 C   -1.272200      9.4999997E-03 -2.4400000E-02
 C    4.881600      0.5364000      0.2651000    
 C   -1.774000       1.198100     -0.5446000    
 C   -2.119900     -0.9064000      0.5906000    
 C   -3.138000       1.473800     -0.4488000    
 C   -3.484000     -0.6308000      0.6861000    
 C   -3.993100      0.5594000      0.1664000    
 H    2.692600      0.4898000      -1.423100    
 H    3.215200      0.8560000       1.598200    
 H    3.418200       2.087700      0.3690000    
 H    5.049300     -0.4978000      0.5792000    
 H    5.131800      0.6242000     -0.7972000    
 H    5.588900       1.158300      0.8245000    
 H   -1.169800       1.910000      -1.096200    
 H   -1.776200      -1.778700       1.131000    
 H   -3.537700       2.393400     -0.8665000    
 H   -4.146000      -1.328200       1.191300    
 H   -5.054600      0.7756000      0.2438000    


%chk=000097728-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097728

0 1
S 2.461389 -1.407436 -0.857467
S -0.235042 -2.880606 -0.900538
O 0.743189 2.067832 0.029914
N 0.144879 -0.191386 -0.341607
C 2.521316 0.454080 -0.467452
C 3.419926 0.783509 0.746461
C 1.071007 0.888552 -0.238317
C 0.646372 -1.469497 -0.672038
C -1.273399 0.048087 -0.121809
C 4.908246 0.479408 0.487220
C -1.965577 0.926831 -0.982127
C -1.928401 -0.581314 0.958934
C -3.337189 1.175205 -0.756831
C -3.300702 -0.331288 1.173330
C -4.006820 0.545778 0.317417
H 2.902283 0.964351 -1.370492
H 3.060407 0.220424 1.628059
H 3.281416 1.859652 0.967070
H 5.071783 -0.594953 0.283703
H 5.289485 1.054299 -0.377371
H 5.517232 0.750233 1.367589
H -1.438898 1.412020 -1.809393
H -1.374336 -1.259422 1.614557
H -3.879482 1.857576 -1.419680
H -3.815826 -0.819798 2.007094
H -5.071659 0.738062 0.487774


