%chk=000125683.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125683

0 1
 S  -0.4599000       2.450000       2.229300    
 P  -0.3661000       2.251500      0.2893000    
 O   -1.001400      0.9068000     -0.3600000    
 O    1.121400       2.259800     -0.3592000    
 O   -1.085600       3.413200     -0.5968000    
 O    4.755500      -2.698400      0.9053000    
 O    6.121800      -1.531300     -0.3557000    
 N    5.013600      -1.684600      0.2125000    
 C   -2.522500     -0.9634000     -0.2067000    
 C   -3.840600      -1.425300      2.1900000E-02
 C   -2.257700      0.4145000     -0.1475000    
 C   -1.508100      -1.893100     -0.4877000    
 C   -4.855000     -0.4955000      0.3029000    
 C   -3.277800       1.324000      0.1330000    
 C   -4.105400      -2.803200     -3.7300002E-02
 C   -4.573900      0.8698000      0.3577000    
 C   -1.789200      -3.258500     -0.5426000    
 C   -3.085400      -3.712700     -0.3178000    
 C    2.077900       1.290700     -0.2188000    
 C    1.806800      0.1602000      0.5451000    
 C    3.312400       1.444000     -0.8414000    
 C    4.020800     -0.6799000      6.6699997E-02
 C    2.781000     -0.8277000      0.6884000    
 C    4.286500      0.4559000     -0.6981000    
 C  -0.5693000       4.733400     -0.5827000    
 H  -0.4859000      -1.572700     -0.6735000    
 H   -5.875500     -0.8279000      0.4815000    
 H   -3.111800       2.393400      0.1775000    
 H   -5.111200      -3.180700      0.1351000    
 H   -5.368500       1.578100      0.5742000    
 H  -0.9958000      -3.967000     -0.7621000    
 H   -3.303600      -4.775700     -0.3610000    
 H   0.8622000     -5.2000000E-03   1.047000    
 H    3.523000       2.327300      -1.437800    
 H    2.539100      -1.699600       1.290900    
 H    5.240900      0.6051000      -1.196800    
 H   0.4651000       4.739800     -0.9352000    
 H  -0.6229000       5.149600      0.4261000    
 H   -1.174100       5.350400      -1.251700    


%chk=000125683-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125683

0 1
S -0.428682 2.307940 2.195144
P -0.381314 2.244343 0.146637
O -1.185311 0.977390 -0.718203
O 1.171285 2.090189 -0.654544
O -0.954912 3.615328 -0.714568
O 5.040938 -2.716585 1.043398
O 6.411454 -1.495857 -0.313589
N 5.279191 -1.705151 0.274295
C -2.641923 -0.913815 -0.275636
C -3.960932 -1.425223 0.041365
C -2.486792 0.510044 -0.356804
C -1.562468 -1.828690 -0.498360
C -5.041356 -0.506982 0.258104
C -3.545639 1.393716 -0.156141
C -4.141395 -2.845305 0.132712
C -4.837278 0.870742 0.159346
C -1.775397 -3.205703 -0.400544
C -3.072828 -3.718466 -0.080475
C 2.138478 1.111202 -0.362691
C 1.907618 -0.007039 0.476515
C 3.391026 1.309378 -0.993933
C 4.191584 -0.729213 0.052584
C 2.946538 -0.931448 0.687129
C 4.425746 0.382820 -0.789205
C -0.561569 4.965143 -0.232884
H -0.578441 -1.431604 -0.763448
H -6.033275 -0.903769 0.501922
H -3.388116 2.472977 -0.251890
H -5.137493 -3.235326 0.372766
H -5.667154 1.566255 0.320515
H -0.947440 -3.901410 -0.574394
H -3.223523 -4.800899 -0.007386
H 0.943046 -0.150818 0.971343
H 3.527241 2.183545 -1.636029
H 2.808213 -1.802840 1.332142
H 5.403320 0.503785 -1.262443
H 0.497673 5.155771 -0.474215
H -0.735425 5.057268 0.854520
H -1.213886 5.653410 -0.789055


