%chk=000088779.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088779

0 1
 S    1.359900      -1.752200     -0.3881000    
 N   -4.829700       1.129200      0.2380000    
 C   -1.394900      -1.380600     -0.2875000    
 C  -5.4600000E-02 -0.6588000     -0.1319000    
 C   -2.604300     -0.4966000     -0.1023000    
 C   -3.151500     -0.3483000       1.157400    
 C   -3.146500      0.1509000      -1.195400    
 C    2.685500     -0.5885000     -0.1322000    
 C    3.211200     -0.4001000       1.146000    
 C    3.197500      0.1337000      -1.210200    
 C   -4.260800      0.4736000       1.274500    
 C   -4.256200      0.9504000     -0.9731000    
 C    4.248600      0.5106000       1.346400    
 C    4.235100       1.044200      -1.009900    
 C    4.760600       1.232600      0.2685000    
 H   -1.455100      -2.212000      0.4283000    
 H   -1.453000      -1.848200      -1.280200    
 H   3.1999999E-03  0.1675000     -0.8499000    
 H   1.2300000E-02 -0.2207000      0.8708000    
 H   -2.739400     -0.8462000       2.027700    
 H   -2.730600      4.9100000E-02  -2.191400    
 H    2.824800     -0.9534000       1.998400    
 H    2.800500      6.9999998E-04  -2.213600    
 H   -4.735900      0.6315000       2.237100    
 H   -4.727600       1.485900      -1.790600    
 H    4.657800      0.6576000       2.341700    
 H    4.633700       1.606700      -1.849000    
 H    5.568300       1.941700      0.4244000    


%chk=000088779-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088779

0 1
S 1.377403 -1.815642 -0.182827
N -4.904749 1.183893 0.109101
C -1.417773 -1.462262 -0.241100
C -0.123034 -0.646693 -0.018811
C -2.642283 -0.568021 -0.124615
C -3.303737 -0.375158 1.114822
C -3.148005 0.141102 -1.244018
C 2.738857 -0.574409 -0.024424
C 3.469772 -0.488360 1.183698
C 3.073563 0.256559 -1.120198
C -4.414116 0.496380 1.184143
C -4.264335 0.992350 -1.083636
C 4.535535 0.435912 1.295661
C 4.132360 1.186074 -1.000084
C 4.865111 1.276365 0.207078
H -1.465632 -2.276375 0.506117
H -1.378138 -1.932960 -1.241236
H -0.016207 0.150228 -0.773734
H -0.096376 -0.196706 0.987449
H -2.964609 -0.900346 2.015133
H -2.685208 0.027797 -2.231213
H 3.204655 -1.139419 2.023031
H 2.518632 0.164328 -2.060140
H -4.941229 0.657490 2.131651
H -4.672959 1.546932 -1.936306
H 5.102781 0.499137 2.230944
H 4.389536 1.829045 -1.849186
H 5.689084 1.993060 0.296599


