%chk=000095747.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095747

0 1
 S   0.7330000     -2.0600000E-02   1.521600    
 O   -1.786300      -1.522900     -0.6947000    
 N   0.8157000      0.7720000     -0.9314000    
 C   -1.422100      0.7334000      5.0700001E-02
 C   8.7000001E-03  0.5432000      7.8199998E-02
 C   -2.275200     -0.3019000     -0.3337000    
 C    2.277200      3.4800000E-02  0.7566000    
 C    2.120400      0.4850000     -0.5577000    
 C   -1.951000       1.972400      0.4144000    
 C   -3.655000     -9.8399997E-02 -0.3539000    
 C    3.536700     -0.2963000       1.282000    
 C    3.266400      0.6074000      -1.373100    
 C   -3.330900       2.175800      0.3941000    
 C   -4.182800       1.140500      9.8999999E-03
 C    4.654400     -0.1662000      0.4538000    
 C    4.523300      0.2795000     -0.8567000    
 C   -2.211300      -2.643500      7.7299997E-02
 C   -1.121400      -3.694000      6.2700003E-02
 H   -1.301600       2.791400      0.7152000    
 H   -4.331900     -0.8917000     -0.6595000    
 H    3.646600     -0.6450000       2.304200    
 H    3.175500      0.9546000      -2.398500    
 H   -3.741800       3.140600      0.6765000    
 H   -5.256900       1.299700     -8.1000002E-03
 H   -2.416300      -2.351900       1.115000    
 H   -3.127200      -3.052700     -0.3626000    
 H    5.638600     -0.4173000      0.8408000    
 H    5.404000      0.3743000      -1.486100    
 H   -1.420100      -4.575500      0.6368000    
 H  -0.8954000      -4.001000     -0.9639000    
 H  -0.1940000      -3.294500      0.4861000    


%chk=000095747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095747

0 1
S 0.981389 -1.260845 0.206280
O -1.736216 -1.739063 0.286184
N 1.024908 1.389052 -0.289326
C -1.289311 0.581391 -0.149163
C 0.166477 0.393403 -0.106197
C -2.248864 -0.463327 0.039626
C 2.568609 -0.406998 0.056034
C 2.363809 0.987571 -0.207252
C -1.776860 1.896729 -0.398880
C -3.636933 -0.186755 -0.024825
C 3.864616 -0.949963 0.164972
C 3.481672 1.845456 -0.362587
C -3.154027 2.173711 -0.461619
C -4.086071 1.126457 -0.274333
C 4.967698 -0.081506 0.007264
C 4.776142 1.303943 -0.254251
C -2.675697 -2.864695 0.484408
C -1.829310 -4.109045 0.736142
H -1.032753 2.685579 -0.541200
H -4.368763 -0.986296 0.117094
H 4.021289 -2.014390 0.365591
H 3.315956 2.908116 -0.563065
H -3.499577 3.194092 -0.654810
H -5.161965 1.327619 -0.321564
H -3.332725 -2.640675 1.349004
H -3.301782 -2.976458 -0.423753
H 5.983752 -0.483030 0.087801
H 5.648372 1.955833 -0.372521
H -2.485264 -4.984701 0.892032
H -1.169093 -4.312786 -0.123571
H -1.200178 -3.977222 1.632485


