%chk=000035592.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035592

0 1
 S   0.2151000       1.070000       2.556100    
 S   -3.580500      -2.137600      0.6337000    
 S    1.549700      -3.196500     -0.3433000    
 N   -1.575300     -0.6243000       1.534400    
 N   0.7347000      -1.101200       1.094100    
 N  -0.9746000      -2.546300      0.2294000    
 C    1.082000       2.010900       1.315200    
 C   -4.201800     -0.6799000     -0.1930000    
 C    2.833800      -1.998800     -0.6755000    
 C  -0.2611000     -0.3792000       1.625800    
 C   -1.858200      -1.725800      0.8205000    
 C   0.3024000      -2.171900      0.4087000    
 C   0.4202000       2.411100      0.1543000    
 C   -3.683500     -0.3124000      -1.432100    
 C    2.570700     -0.9143000      -1.508600    
 C    2.422500       2.347400       1.504900    
 C   -5.202100      8.2300000E-02  0.4051000    
 C    4.092000      -2.154400     -9.9699996E-02
 C    1.098500       3.147400     -0.8168000    
 C   -4.168300      0.8251000      -2.077500    
 C    3.572900      2.0700000E-02  -1.767800    
 C    3.100700       3.083900      0.5337000    
 C   -5.687000       1.219800     -0.2404000    
 C    5.094200      -1.219300     -0.3590000    
 C    2.438700       3.484000     -0.6272000    
 C   -5.170100       1.591200      -1.481700    
 C    4.834400     -0.1318000      -1.193100    
 H  -0.6254000       2.164000     -1.3300000E-02
 H   -2.905900     -0.8973000      -1.917000    
 H    1.596500     -0.7782000      -1.971600    
 H    2.955600       2.043000       2.402100    
 H   -5.616100     -0.1917000       1.372100    
 H    4.312000      -2.995200      0.5533000    
 H   0.5833000       3.458800      -1.720800    
 H   -3.766500       1.113900      -3.044300    
 H    3.371900      0.8654000      -2.419900    
 H    4.144800       3.344300      0.6802000    
 H   -6.466900       1.816700      0.2234000    
 H    6.076500      -1.337400      8.8799998E-02
 H    2.967400       4.056000      -1.383900    
 H   -5.547700       2.476900      -1.984100    
 H    5.614400      0.5966000      -1.394800    


%chk=000035592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000035592

0 1
S -0.640413 2.131422 -0.173951
S -3.675299 -2.365702 -0.225746
S 1.618413 -2.947494 -0.385976
N -1.976368 -0.179720 -0.209618
N 0.438360 -0.429982 -0.278964
N -0.990906 -2.391560 -0.298229
C 1.163716 2.525362 -0.235544
C -4.837912 -0.928541 -0.157262
C 3.116758 -1.866587 -0.370379
C -0.701912 0.313098 -0.230768
C -2.055637 -1.537353 -0.246076
C 0.227013 -1.777218 -0.309977
C 1.622431 3.328397 -1.303378
C -5.361908 -0.405224 -1.358803
C 3.391256 -0.984480 -1.438416
C 2.032314 2.138824 0.808659
C -5.241888 -0.420814 1.096223
C 4.037692 -2.036661 0.687169
C 2.971432 3.755311 -1.321176
C -6.300921 0.650468 -1.302222
C 4.601446 -0.257046 -1.439348
C 3.380675 2.556434 0.774795
C -6.180471 0.635347 1.144968
C 5.255410 -1.316021 0.669777
C 3.850451 3.369453 -0.283760
C -6.709701 1.170982 -0.052369
C 5.537351 -0.426239 -0.391622
H 0.936282 3.615841 -2.106684
H -5.038456 -0.813578 -2.321409
H 2.667760 -0.860177 -2.249128
H 1.664774 1.513400 1.627053
H -4.826379 -0.841295 2.017324
H 3.807253 -2.722011 1.509301
H 3.328728 4.384586 -2.143702
H -6.708898 1.063354 -2.231190
H 4.810846 0.439677 -2.257993
H 4.061290 2.246110 1.574688
H -6.494790 1.036905 2.114399
H 5.975916 -1.452312 1.483752
H 4.895093 3.699893 -0.298717
H -7.437214 1.989277 -0.011536
H 6.480311 0.131773 -0.403764


