%chk=000124881.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124881

0 1
 S    5.659100       1.553400     -0.5408000    
 N    3.348200      0.3022000      0.3272000    
 C   0.5792000     -0.6996000     -5.7000001E-03
 C  -0.7039000      -1.289800      0.5850000    
 C    1.790000      -1.583400      0.3081000    
 C   -1.909800     -0.4509000      0.2474000    
 C    3.088000      -1.015300     -0.2551000    
 C   -2.288300      0.5735000       1.102500    
 C   -2.622200     -0.7166000     -0.9126000    
 C   -3.404300       1.349900      0.7904000    
 C   -3.738300      5.9700001E-02  -1.224600    
 C   -4.129300       1.093100     -0.3733000    
 C    4.331700      0.8239000     -4.8500001E-02
 H   0.7312000      0.3098000      0.3957000    
 H   0.4780000     -0.5950000      -1.093400    
 H  -0.6110000      -1.379400       1.675100    
 H  -0.8546000      -2.312000      0.2143000    
 H    1.630600      -2.586200     -0.1059000    
 H    1.884900      -1.694300       1.395400    
 H    3.906000      -1.708800     -1.8700000E-02
 H    3.010600     -0.9491000      -1.348800    
 H   -1.729200      0.7826000       2.010100    
 H   -2.324700      -1.517700      -1.583100    
 H   -3.708500       2.154800       1.453100    
 H   -4.302400     -0.1399000      -2.131000    
 H   -4.998000       1.697700     -0.6165000    


%chk=000124881-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124881

0 1
S 4.522402 2.550132 0.663057
N 3.605601 -0.021815 -0.121201
C 0.634522 -0.845074 -0.105276
C -0.644633 -1.290338 0.654589
C 1.847513 -1.745285 0.211695
C -1.853789 -0.431152 0.307758
C 3.145534 -1.314446 -0.520816
C -2.145161 0.746265 1.043412
C -2.689796 -0.767730 -0.787743
C -3.241685 1.567143 0.694121
C -3.787465 0.049402 -1.141642
C -4.066962 1.221153 -0.400897
C 3.996286 1.066684 0.213966
H 0.865841 0.205028 0.157877
H 0.433936 -0.859218 -1.195618
H -0.444835 -1.243821 1.743247
H -0.853093 -2.351522 0.412216
H 1.631848 -2.788837 -0.093872
H 2.036881 -1.759910 1.302646
H 3.946741 -2.054930 -0.324304
H 2.966633 -1.309027 -1.615465
H -1.511660 1.020081 1.896541
H -2.483221 -1.678700 -1.363971
H -3.453693 2.471650 1.275573
H -4.425557 -0.227958 -1.988568
H -4.919191 1.854828 -0.671026


