%chk=000139941.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139941

0 1
 S    1.629000      -2.209900     -1.1300000E-02
 N    2.040100      0.5247000      3.0000000E-03
 C  -0.2875000     -0.2822000     -5.5000000E-03
 C    1.136800     -0.5752000     -1.0800000E-02
 C  -0.9719000     -0.1253000      -1.210800    
 C  -0.9696000     -0.1583000       1.205000    
 C    1.623700       1.928900      2.2200000E-02
 C    3.493700      0.3401000     -3.0000001E-04
 C   -2.338100      0.1555000      -1.205900    
 C   -2.336000      0.1224000       1.209900    
 C   -3.020200      0.2793000      4.4999998E-03
 H  -0.4517000     -0.2165000      -2.161000    
 H  -0.4481000     -0.2749000       2.151600    
 H    2.045000       2.404600      0.9130000    
 H   0.5416000       2.057200      4.0300000E-02
 H    2.017200       2.420600     -0.8725000    
 H    3.909600      0.8857000     -0.8534000    
 H    3.817500     -0.6970000     -7.2200000E-02
 H    3.895400      0.7646000      0.9252000    
 H   -2.870700      0.2785000      -2.144300    
 H   -2.867000      0.2199000       2.152300    
 H   -4.083900      0.4984000      8.3999997E-03


%chk=000139941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139941

0 1
S 1.722194 -1.905529 1.051233
N 2.059850 0.544787 -0.086823
C -0.286882 -0.151403 0.241659
C 1.182939 -0.410819 0.380560
C -0.843969 0.260699 -1.001502
C -1.159576 -0.403719 1.332658
C 1.702224 1.961417 -0.322112
C 3.506530 0.253693 -0.134200
C -2.239533 0.419646 -1.145457
C -2.551617 -0.221840 1.193769
C -3.098053 0.188851 -0.045732
H -0.185589 0.420034 -1.863430
H -0.730774 -0.756569 2.276281
H 2.348616 2.609490 0.300091
H 0.654569 2.146511 -0.049954
H 1.850578 2.238965 -1.383028
H 3.992889 0.979071 -0.808642
H 3.666442 -0.774052 -0.497842
H 3.961522 0.321100 0.872871
H -2.655375 0.715325 -2.115153
H -3.211350 -0.411196 2.047705
H -4.180736 0.316638 -0.155551


