%chk=000092478.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092478

0 1
 S    4.114200       1.066700     -1.1100000E-02
 P    5.773600     -0.2089000     -6.3900001E-02
 O   -8.330400      3.8300000E-02  1.8600000E-02
 O    7.121500      0.6840000      7.2099999E-02
 O    5.823900      -1.080200       1.303900    
 O    5.767900      -1.066800      -1.299900    
 N   0.2347000     -0.1210000      3.1000001E-03
 N   -4.683000     -0.4468000     -9.9999997E-05
 C   -2.237200     -0.2849000      2.3000001E-03
 C   -1.013000      0.6332000      1.3000000E-03
 C   -3.559600      0.4836000     -1.8600000E-02
 C    1.383200      0.7741000      1.2800000E-02
 C   -5.950200      0.2691000     -3.0099999E-02
 C    2.672100     -3.7500001E-02 -2.3399999E-02
 C   -7.117500     -0.7029000      3.3100002E-02
 H   -2.192000     -0.9499000     -0.8706000    
 H   -2.201300     -0.9279000      0.8919000    
 H   -1.057200       1.281900     -0.8824000    
 H   -1.058100       1.277900      0.8876000    
 H   -3.604000       1.151000      0.8507000    
 H   -3.598700       1.103600     -0.9223000    
 H   0.2715000     -0.7246000     -0.8179000    
 H    1.342700       1.443300     -0.8562000    
 H    1.360400       1.391500      0.9194000    
 H   -4.634100      -1.028100      0.8362000    
 H   -6.034400      0.8687000     -0.9451000    
 H   -6.024200      0.9700000      0.8112000    
 H    2.738300     -0.7019000      0.8447000    
 H    2.719400     -0.6547000     -0.9270000    
 H   -7.113900      -1.380000     -0.8277000    
 H   -7.088100      -1.297100      0.9525000    
 H   -9.058400     -0.6052000      5.9099998E-02
 H    7.991000      0.2477000     -5.3399999E-02
 H    6.481900      -1.804000       1.378300    


%chk=000092478-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092478

0 1
S 4.401106 0.723358 1.552963
P 5.095028 -0.445549 -0.257612
O -8.107117 -0.065164 -0.985217
O 5.512035 0.628802 -1.565258
O 6.716150 -0.781728 0.195119
O 4.126127 -1.635843 -0.683913
N 0.376668 -0.115061 0.795639
N -4.533803 -0.302691 0.040279
C -2.079767 -0.201771 0.422646
C -0.775651 0.581733 0.181171
C -3.305670 0.481323 -0.213046
C 1.678707 0.559401 0.656281
C -5.763354 0.263596 -0.556289
C 2.670559 -0.068592 1.648034
C -6.920787 -0.731525 -0.422587
H -1.994237 -1.224809 0.005086
H -2.226255 -0.311220 1.515875
H -0.643898 0.745391 -0.918845
H -0.852566 1.585403 0.645221
H -3.376725 1.535033 0.162633
H -3.166181 0.546596 -1.310821
H 0.425901 -1.099574 0.497843
H 2.102504 0.504428 -0.377627
H 1.544734 1.631064 0.895212
H -4.652504 -0.484517 1.047793
H -5.577182 0.447700 -1.630760
H -6.075643 1.237612 -0.108615
H 2.348877 0.088995 2.690455
H 2.798695 -1.148146 1.461881
H -6.671279 -1.662396 -0.971216
H -7.082889 -0.987061 0.649066
H -8.872752 -0.692004 -0.977035
H 4.770578 0.842897 -2.186830
H 7.351592 -0.783483 -0.568428


