%chk=000131298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131298

0 1
 S    1.442000      -2.136700     -4.1700002E-02
 O   -5.371200      0.4001000      1.9200001E-02
 N   -1.910100      0.7076000      1.5699999E-02
 N   -1.195300      -1.598500     -3.1800002E-02
 N   -3.434600     -0.9075000     -1.2500000E-02
 C    1.885900      0.4029000      1.8000000E-03
 C   0.4696000      0.2402000     -8.9999998E-04
 C    2.644500       1.694100      4.5100000E-02
 C    2.524200     -0.8230000     -1.2200000E-02
 C    4.120600       1.503400     -0.3365000    
 C  -0.5916000       1.308400      2.1800000E-02
 C    4.008400      -1.018700     -3.6200002E-02
 C    4.731000      0.2784000      0.3589000    
 C   8.2900003E-02  -1.099200     -2.4300000E-02
 C   -2.093900     -0.6587000     -1.0900000E-02
 C   -3.156700       1.432400      3.2099999E-02
 C   -4.155700      0.2748000      1.2500000E-02
 H    2.187900       2.428800     -0.6278000    
 H    2.582800       2.099300       1.062700    
 H    4.205900       1.377800      -1.423600    
 H    4.685500       2.404600     -7.2899997E-02
 H  -0.4710000       1.924100      0.9201000    
 H  -0.4779000       1.954900     -0.8555000    
 H    4.311300      -1.824500      0.6420000    
 H    4.311300      -1.307100      -1.050500    
 H    4.669700      0.4165000       1.446100    
 H    5.794300      0.1952000      0.1069000    
 H   -3.281400       2.049300     -0.8610000    
 H   -3.277200       2.015100      0.9485000    
 H   -3.850100      -1.831700     -2.9400000E-02


%chk=000131298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131298

0 1
S 1.482336 -2.284789 -0.062972
O -5.490713 0.479075 0.012035
N -1.909029 0.682138 0.021213
N -1.247959 -1.659436 -0.040975
N -3.536543 -0.875610 -0.021438
C 1.903222 0.343400 0.007026
C 0.471482 0.168995 0.009199
C 2.629005 1.678415 0.042181
C 2.600685 -0.860965 -0.023200
C 4.119114 1.522906 -0.353667
C -0.561266 1.286969 0.037160
C 4.101265 -1.014337 -0.039530
C 4.770563 0.323688 0.375823
C 0.064607 -1.165445 -0.027906
C -2.137955 -0.690820 -0.015619
C -3.163018 1.439381 0.039826
C -4.245807 0.332130 0.009261
H 2.133973 2.403824 -0.635105
H 2.561771 2.113510 1.062137
H 4.193501 1.362032 -1.447928
H 4.667246 2.456468 -0.124089
H -0.446429 1.922376 0.945172
H -0.444784 1.966770 -0.838481
H 4.425602 -1.826650 0.640242
H 4.447290 -1.302608 -1.054795
H 4.666175 0.461893 1.470234
H 5.853407 0.278798 0.152722
H -3.276588 2.105078 -0.839602
H -3.278669 2.057647 0.952916
H -3.961383 -1.802533 -0.046139


