%chk=000077365.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077365

0 1
 S  -0.2776000       2.888300      2.0999999E-03
 N    2.013700       1.691500     -5.0000002E-04
 C  -0.2681000       1.173400      1.3000000E-03
 C    1.033900      0.7175000      7.9999998E-04
 C   -1.525600      0.4641000      1.0000000E-03
 C    1.382400     -0.6759000      3.9999999E-04
 C    1.438400       2.873400     -1.9999999E-04
 C   -2.132600      0.1208000       1.208400    
 C   -2.131000      0.1223000      -1.207600    
 C    1.551200      -1.352100      -1.207800    
 C    1.552200      -1.352700       1.208200    
 C    2.168800       4.159700     -1.8000000E-03
 C   -3.347100     -0.5654000       1.207200    
 C   -3.345400     -0.5638000      -1.208800    
 C    1.889800      -2.705400      -1.208300    
 C    1.890900      -2.705800       1.207700    
 C   -3.953400     -0.9077000     -1.4000000E-03
 C    2.059700      -3.382100     -6.0000003E-04
 H   -1.672500      0.3787000       2.159400    
 H   -1.669700      0.3813000      -2.157600    
 H    1.422600     -0.8391000      -2.158000    
 H    1.424400     -0.8400000       2.158600    
 H    1.924400       4.749300     -0.8912000    
 H    3.250000       3.987200     -3.1999999E-03
 H    1.926900       4.750100      0.8878000    
 H   -3.820300     -0.8337000       2.147200    
 H   -3.817400     -0.8309000      -2.149800    
 H    2.021000      -3.232100      -2.149000    
 H    2.023100      -3.233000       2.148000    
 H   -4.898800      -1.442300     -2.4000001E-03
 H    2.323200      -4.435700     -8.9999998E-04


%chk=000077365-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077365

0 1
S -0.336034 3.050590 0.002363
N 1.987030 1.746513 -0.000520
C -0.329431 1.229588 0.000471
C 0.979249 0.757640 -0.000044
C -1.605803 0.472204 0.000456
C 1.365821 -0.686549 -0.000541
C 1.508566 2.976247 -0.000462
C -2.228464 0.107552 1.223724
C -2.227163 0.105345 -1.222814
C 1.564735 -1.377081 -1.222517
C 1.560179 -1.379200 1.220968
C 2.326214 4.233960 -0.001329
C -3.442312 -0.614104 1.223272
C -3.441007 -0.616321 -1.222362
C 1.948658 -2.736570 -1.223739
C 1.944066 -2.738705 1.221271
C -4.052308 -0.977750 0.000455
C 2.139200 -3.421523 -0.001464
H -1.755584 0.391295 2.170452
H -1.753261 0.387356 -2.169547
H 1.422886 -0.845011 -2.169945
H 1.414726 -0.848794 2.168783
H 2.118443 4.853859 -0.892472
H 3.393324 3.960074 -0.002543
H 2.120440 4.853733 0.890359
H -3.910220 -0.892412 2.174095
H -3.907893 -0.896351 -2.173182
H 2.099066 -3.259178 -2.175038
H 2.090909 -3.262961 2.172220
H -4.994275 -1.537496 0.000460
H 2.437345 -4.476049 -0.001829


