%chk=000079924.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079924

0 1
 S   0.9062000      -4.174700     -2.0999999E-03
 N   1.5400000E-02 -0.2095000      3.3799998E-02
 C   0.6863000      0.9256000      0.6588000    
 C   -1.374000     -0.2982000      0.4854000    
 C    2.109700       1.138600      0.1157000    
 C   -2.187100      0.9599000      0.1352000    
 C   0.7265000      -1.453900      0.3296000    
 C    2.058700       1.344900      -1.400500    
 C    2.817600       2.326300      0.7729000    
 C   -2.153800       1.191800      -1.377900    
 C   -3.639700      0.8715000      0.6103000    
 C   3.4200002E-02  -2.622300     -0.3611000    
 H   0.7262000      0.8049000       1.749900    
 H   0.1649000       1.867100      0.4670000    
 H   -1.423900     -0.4749000       1.568300    
 H   -1.910700      -1.117500      1.9999999E-04
 H    2.743900      0.2726000      0.3308000    
 H   -1.785200       1.844900      0.6376000    
 H   0.7831000      -1.624700       1.413200    
 H    1.749000      -1.426100     -5.8300000E-02
 H    1.675400      0.4622000      -1.921900    
 H    1.427700       2.200300      -1.665900    
 H    3.062300       1.538100      -1.795600    
 H    2.279100       3.261700      0.5867000    
 H    3.836100       2.438200      0.3863000    
 H    2.883300       2.183700       1.856600    
 H   -2.543600      0.3251000      -1.923000    
 H   -2.769800       2.057000      -1.647200    
 H   -1.142200       1.396400      -1.740800    
 H   -4.161300      3.2299999E-02  0.1377000    
 H   -4.187100       1.789300      0.3710000    
 H   -3.682000      0.7282000       1.695200    
 H  -1.4000000E-03  -2.481200      -1.446300    
 H  -0.9776000      -2.808300      1.3000000E-03
 H   9.9699996E-02  -4.971700     -0.7183000    


%chk=000079924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079924

0 1
S 0.838583 -4.243581 -0.187848
N -0.003021 -0.211153 0.385456
C 0.866567 0.863766 0.928848
C -1.433415 -0.063533 0.762068
C 2.118373 1.160211 0.061680
C -2.211270 0.953440 -0.114413
C 0.529742 -1.576789 0.610211
C 1.722192 1.728208 -1.318745
C 3.066403 2.121464 0.816634
C -2.339366 0.450184 -1.568797
C -3.597122 1.239948 0.509162
C 0.230467 -2.482225 -0.597806
H 1.193967 0.629334 1.973772
H 0.264688 1.791406 0.989949
H -1.535823 0.227072 1.838161
H -1.924577 -1.051311 0.657888
H 2.659295 0.204380 -0.102277
H -1.635889 1.902807 -0.129404
H 0.114426 -2.039453 1.537924
H 1.624675 -1.520248 0.746169
H 0.989437 1.064750 -1.810776
H 1.261804 2.730211 -1.211149
H 2.604733 1.831155 -1.977082
H 2.560774 3.083369 1.030790
H 3.966018 2.343953 0.214046
H 3.399067 1.691619 1.780517
H -2.986366 -0.448504 -1.615683
H -2.787109 1.221889 -2.222109
H -1.346072 0.182134 -1.970262
H -4.198110 0.312005 0.577330
H -4.166096 1.961686 -0.105137
H -3.504746 1.658185 1.529535
H 0.762663 -2.112626 -1.488405
H -0.851222 -2.524304 -0.805387
H 0.592228 -4.781850 -1.440257


