%chk=000129037.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129037

0 1
 S    5.814300      0.4412000      1.5600000E-02
 N   0.6100000      0.3478000      3.3000000E-03
 N   -4.330300      0.5283000     -1.3800000E-02
 C  -0.6137000     -0.4442000     -1.6799999E-02
 C   -1.865800      0.4375000     -2.8400000E-02
 C    1.785400     -0.5119000      3.5000001E-03
 C   -3.182700     -0.3365000     -3.5999998E-02
 C    3.061100      0.3311000      1.5400000E-02
 C    4.300100     -0.5610000     -6.3999998E-03
 C   -5.578400     -0.2323000      6.3800000E-02
 H  -0.6292000      -1.083200     -0.9082000    
 H  -0.6508000      -1.100200      0.8617000    
 H   -1.845300       1.094700      0.8516000    
 H   -1.830500       1.094300     -0.9082000    
 H    1.776300      -1.168500      0.8822000    
 H    1.784600      -1.147100     -0.8907000    
 H   0.6188000      0.9479000      0.8275000    
 H   -3.209400     -0.9798000     -0.9245000    
 H   -3.194500     -0.9966000      0.8404000    
 H    3.064500      0.9981000     -0.8568000    
 H    3.071800      0.9647000      0.9120000    
 H    4.311300      -1.185000     -0.9058000    
 H    4.313000      -1.222600      0.8656000    
 H   -4.342900       1.114500     -0.8477000    
 H   -5.618500     -0.8333000      0.9780000    
 H   -5.700700     -0.8877000     -0.8046000    
 H   -6.424400      0.4613000      8.6900003E-02
 H    5.600000       1.072200      -1.148400    


%chk=000129037-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129037

0 1
S 5.945774 0.603649 0.042822
N 0.599483 0.223157 0.005674
N -4.362452 0.536055 -0.009155
C -0.656278 -0.559190 -0.007115
C -1.882800 0.372774 -0.006967
C 1.835108 -0.587562 0.009050
C -3.217451 -0.396735 -0.007055
C 3.083115 0.322565 -0.009965
C 4.389885 -0.485414 -0.020014
C -5.685336 -0.113534 0.023604
H -0.660968 -1.180649 -0.925464
H -0.731763 -1.268951 0.857588
H -1.861606 1.032131 0.883753
H -1.822173 1.032295 -0.895966
H 1.897967 -1.283593 0.886170
H 1.826731 -1.225470 -0.898043
H 0.601286 0.907356 0.776574
H -3.234936 -1.108190 -0.874672
H -3.287963 -1.018074 0.908919
H 3.026669 0.976707 -0.900898
H 3.076309 0.987444 0.876828
H 4.461338 -1.133567 -0.910121
H 4.479580 -1.120285 0.878489
H -4.285855 1.219334 -0.774606
H -5.800854 -0.667231 0.974274
H -5.866365 -0.838881 -0.808668
H -6.478857 0.653999 -0.011561
H 5.706512 1.263558 -1.152276


