%chk=000080205.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080205

0 1
 S   -1.360600      4.8900001E-02  -1.106300    
 S   -4.721300     -0.1592000      -2.125100    
 P   -3.436400     -3.3000000E-02 -0.6475000    
 O   -3.752800       1.229500      0.3425000    
 O   -3.636900      -1.232600      0.4457000    
 O    1.393500      -2.337900      7.5000003E-02
 O    1.302400       2.280500      0.4334000    
 N   0.9212000     -4.1700002E-02  0.3022000    
 C    3.072700     -0.6677000     -2.8200001E-02
 C    3.044100      0.7149000      7.9300001E-02
 C    1.704200      -1.162100      0.1189000    
 C    1.657000       1.124400      0.2965000    
 C  -0.5164000     -8.5299999E-02  0.4811000    
 C    4.247900      -1.359800     -0.2365000    
 C    4.189500       1.478300     -1.5900001E-02
 C    5.421300     -0.6068000     -0.3369000    
 C    5.392300      0.7986000     -0.2275000    
 C   -3.707200       2.557700     -0.1521000    
 C   -3.464900      -2.587200      6.3100003E-02
 C   -4.039400       3.514600      0.9730000    
 C   -3.710200      -3.474000       1.265300    
 H  -0.7915000      -1.030700      0.9568000    
 H  -0.8261000      0.7475000       1.119200    
 H    4.270600      -2.440000     -0.3202000    
 H    4.167800       2.558400      6.8499997E-02
 H    6.370800      -1.109600     -0.5013000    
 H    6.319900       1.359200     -0.3091000    
 H   -2.706700       2.769900     -0.5400000    
 H   -4.432300       2.678600     -0.9617000    
 H   -4.173300      -2.842800     -0.7296000    
 H   -2.448300      -2.737300     -0.3113000    
 H   -4.012400       4.551100      0.6256000    
 H   -5.034500       3.303200       1.378000    
 H   -3.328800       3.399900       1.798300    
 H   -3.585800      -4.528700       1.005100    
 H   -3.015900      -3.225400       2.074900    
 H   -4.721900      -3.323000       1.656100    


%chk=000080205-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080205

0 1
S -1.301645 1.027277 -1.360763
S -4.532852 -0.303441 -2.432801
P -3.358308 0.142174 -0.797585
O -3.949153 1.256301 0.393930
O -3.000214 -1.079133 0.373021
O 0.521591 -1.831393 0.368141
O 1.904443 2.671287 0.197629
N 0.876940 0.523596 0.312434
C 2.779358 -0.809310 0.127104
C 3.197818 0.543580 0.077529
C 1.291548 -0.845788 0.276562
C 1.992586 1.421774 0.190835
C -0.496473 0.962293 0.397104
C 3.701319 -1.863584 0.045335
C 4.551531 0.887030 -0.054711
C 5.073242 -1.526689 -0.090866
C 5.491882 -0.172552 -0.140015
C -4.547168 2.532028 -0.100666
C -2.672499 -2.455351 -0.127783
C -4.972847 3.302278 1.145278
C -2.487051 -3.312812 1.117710
H -1.095041 0.249538 0.985740
H -0.528512 1.979867 0.808297
H 3.367224 -2.904990 0.084999
H 4.862750 1.935561 -0.091225
H 5.822010 -2.322860 -0.159872
H 6.557527 0.056184 -0.246272
H -3.786995 3.084992 -0.686985
H -5.406596 2.292820 -0.755209
H -3.508947 -2.803990 -0.762270
H -1.741935 -2.402504 -0.720798
H -5.437101 4.261006 0.848730
H -5.707325 2.722854 1.729357
H -4.104181 3.519141 1.789661
H -2.270931 -4.354411 0.815331
H -1.636220 -2.943686 1.712756
H -3.398175 -3.308689 1.739638


