%chk=000016421.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016421

0 1
 S    1.756200      -1.628800       2.489200    
 P    1.753300      -1.015200      0.6247000    
 O   0.4714000      -1.569900     -0.2224000    
 O    2.941200      -1.717900     -0.2547000    
 O   -5.062700       1.198300      0.8271000    
 O   -5.653100     -0.2826000     -0.6820000    
 N   -4.784100      0.2585000      4.3699998E-02
 C    1.882300      0.7027000      0.1613000    
 C  -0.8127000      -1.123300     -0.1575000    
 C    1.469800       1.099500      -1.101200    
 C    2.392700       1.615500       1.071200    
 C    4.291300      -1.317700     -8.3499998E-02
 C    1.570400       2.442800      -1.463100    
 C    2.493100       2.958900      0.7092000    
 C   -1.144800     -7.9000004E-02  0.7056000    
 C   -1.796600      -1.709200     -0.9542000    
 C    2.082000       3.372500     -0.5580000    
 C   -3.444200     -0.2065000     -2.4200000E-02
 C   -2.460500      0.3792000      0.7724000    
 C   -3.112400      -1.250800     -0.8874000    
 C    5.167500      -2.126800      -1.016000    
 H    1.090600      0.3861000      -1.825500    
 H    2.723500       1.308700       2.057600    
 H    4.398600     -0.2551000     -0.3171000    
 H    4.594400      -1.483600      0.9544000    
 H    1.255100       2.764000      -2.451600    
 H    2.893200       3.682700       1.413200    
 H  -0.4279000      0.3924000       1.365700    
 H   -1.543200      -2.522800      -1.628400    
 H    2.161800       4.418100     -0.8403000    
 H   -2.684400       1.190500       1.460500    
 H   -3.852300      -1.731200      -1.522600    
 H    6.218300      -1.843200     -0.9095000    
 H    5.067400      -3.197000     -0.8070000    
 H    4.864300      -1.976200      -2.057300    


%chk=000016421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016421

0 1
S 2.037098 -0.715869 2.559394
P 2.067357 -0.292690 0.541270
O 0.708828 -0.990343 -0.417039
O 3.302097 -1.001830 -0.427022
O -5.324033 0.136100 1.395300
O -5.635799 -1.375000 -0.286983
N -4.876909 -0.651570 0.471418
C 2.137567 1.467540 0.004593
C -0.650420 -0.867998 -0.116954
C 2.149101 1.772135 -1.378269
C 2.178667 2.486441 0.982726
C 3.626017 -2.449588 -0.225303
C 2.198186 3.124270 -1.779475
C 2.226463 3.835905 0.568633
C -1.175152 -0.020620 0.894510
C -1.516360 -1.649962 -0.926324
C 2.235193 4.154186 -0.809241
C -3.417798 -0.728916 0.269169
C -2.566346 0.047933 1.085611
C -2.904697 -1.580690 -0.737710
C 4.902757 -2.713231 -1.016583
H 2.120016 0.969026 -2.121077
H 2.178950 2.222156 2.046760
H 3.760996 -2.634404 0.857713
H 2.773799 -3.048495 -0.595299
H 2.206810 3.373749 -2.845601
H 2.258431 4.633232 1.318235
H -0.509867 0.565213 1.534455
H -1.078192 -2.295931 -1.692065
H 2.270813 5.201812 -1.127411
H -3.002681 0.689552 1.855408
H -3.595375 -2.168961 -1.347060
H 5.188308 -3.776531 -0.915490
H 4.754068 -2.492787 -2.087147
H 5.731606 -2.090234 -0.640841


