%chk=000021008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021008

0 1
 S   -2.891000       2.597700      0.8540000    
 S    3.809400       1.670900       1.059600    
 N   -2.133500      0.6225000     -0.9396000    
 N    2.650300     -3.7000000E-02 -0.7942000    
 C   -1.209900      -1.292000      0.2384000    
 C   -1.032300     -0.1332000     -0.5176000    
 C  -0.1021000      -2.032500      0.6506000    
 C   0.2533000      0.2850000     -0.8615000    
 C    1.361200     -0.4557000     -0.4493000    
 C    1.183400      -1.614400      0.3067000    
 C   -2.576600      -1.758900      0.6201000    
 C   -2.445600       1.459000     -0.1689000    
 C    3.133400      0.6886000      1.6000000E-03
 H  -0.2233000      -2.936700       1.241400    
 H   0.3927000       1.186100      -1.455200    
 H    2.039100      -2.200500      0.6319000    
 H   -3.247300      -1.759000     -0.2456000    
 H   -2.558600      -2.785000       1.004000    
 H   -2.994600      -1.118200       1.402900    


%chk=000021008-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000021008

0 1
S -4.322313 2.587875 -0.561044
S 5.309584 1.216980 -0.431091
N -2.098482 0.870849 -0.184889
N 2.686676 0.190686 -0.113940
C -1.243908 -1.337499 0.365279
C -1.019387 0.030584 0.006328
C -0.105559 -2.155381 0.553766
C 0.291536 0.544035 -0.154966
C 1.408576 -0.305135 0.042017
C 1.206626 -1.666371 0.400307
C -2.650058 -1.869667 0.540382
C -3.041288 1.605939 -0.347622
C 3.804095 0.624320 -0.249676
H -0.252250 -3.205476 0.828165
H 0.438370 1.592291 -0.430106
H 2.071771 -2.318737 0.551196
H -3.275428 -1.667518 -0.348670
H -2.643867 -2.958547 0.712896
H -3.156695 -1.392526 1.400969


