%chk=000081609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081609

0 1
 S   1.0600000E-02  -1.104400      3.1999999E-03
 O   1.2200000E-02  -1.816000      -1.274300    
 O  -0.1165000      -1.807900       1.281400    
 N    1.387000     -0.1842000      3.3599999E-02
 N   -1.426600     -0.1291000     -3.3799998E-02
 N    3.133600      0.9734000     -0.7023000    
 N   -3.097800      0.9987000      0.6980000    
 C    2.033100      0.2683000       1.149400    
 C   -2.002300      0.2766000      -1.150100    
 C    2.084300      0.2638000      -1.053800    
 C   -2.053400      0.2837000       1.053100    
 C    3.107800      0.9795000      0.6697000    
 C   -3.072000      0.9977000     -0.6741000    
 H    1.690100      6.0699999E-02   2.153400    
 H   -1.663100      6.5499999E-02  -2.154700    
 H    1.786400      5.2200001E-02  -2.071800    
 H   -1.759400      7.9499997E-02   2.073700    
 H    3.863300       1.496800       1.242800    
 H   -3.823700       1.517900      -1.249700    


%chk=000081609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081609

0 1
S -0.005851 -1.385155 0.007192
O 0.010605 -2.140269 -1.412000
O -0.031417 -2.123219 1.435455
N 1.467807 -0.224657 -0.041764
N -1.463938 -0.206697 0.043475
N 3.207981 0.961663 -0.778686
N -3.190680 1.006129 0.769428
C 1.969642 0.447552 1.092828
C -1.951947 0.468911 -1.095384
C 2.245934 0.109774 -1.158882
C -2.242314 0.142435 1.156424
C 3.046991 1.179204 0.610804
C -3.021001 1.216798 -0.620072
H 1.536252 0.319709 2.080591
H -1.516345 0.332069 -2.080965
H 2.076253 -0.294325 -2.152358
H -2.081826 -0.260687 2.151827
H 3.720889 1.839180 1.150093
H -3.683439 1.884285 -1.164307


