%chk=000167940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167940

0 1
 S   0.3568000      0.8188000      -1.174200    
 S   -2.793700       2.043600      -2.149500    
 P   -1.626200       1.425800     -0.6986000    
 O   -2.304600      0.2099000      0.1588000    
 O   -1.510900       2.519000      0.5122000    
 C   -3.233000      -1.957500      0.5623000    
 C   -2.618400      -1.022200     -0.4693000    
 C   -3.582100      -3.313800     -4.3800000E-02
 C   -4.155700      -4.259300      0.9993000    
 C    1.016400      0.1032000      0.3450000    
 C    2.430000     -0.3817000      0.1766000    
 C  -0.9600000       3.802700      0.2690000    
 C    3.485900      0.4832000      0.4325000    
 C    2.661900      -1.688500     -0.2322000    
 C    4.797000      3.3500001E-02  0.2766000    
 C    3.973200      -2.138200     -0.3879000    
 C  -0.9773000       4.598600       1.556500    
 C    5.040700      -1.277100     -0.1335000    
 H   -4.128400      -1.490300      0.9910000    
 H   -2.532100      -2.084000       1.397100    
 H   -3.327400     -0.8504000      -1.284600    
 H   -1.706300      -1.460300     -0.8856000    
 H   -4.310200      -3.183700     -0.8529000    
 H   -2.685900      -3.767200     -0.4834000    
 H   0.3717000     -0.7239000      0.6625000    
 H   0.9666000      0.8538000       1.142000    
 H   -3.436900      -4.436900       1.805600    
 H   -5.070900      -3.849800       1.438700    
 H   -4.399800      -5.223900      0.5434000    
 H   -1.549300       4.322900     -0.4910000    
 H   6.7299999E-02   3.698000     -9.1700003E-02
 H    3.307800       1.506400      0.7516000    
 H    1.838000      -2.367400     -0.4338000    
 H    5.628300      0.7039000      0.4744000    
 H    4.163100      -3.158700     -0.7075000    
 H  -0.4000000       4.086600       2.333600    
 H   -2.000200       4.699000       1.934100    
 H  -0.5572000       5.596900       1.404900    
 H    6.061600      -1.627200     -0.2550000    


%chk=000167940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167940

0 1
S 0.496309 1.694513 -1.746425
S -3.095474 2.214540 -2.012482
P -1.557869 1.706420 -0.732599
O -1.667134 0.210451 0.140820
O -1.308263 2.653725 0.704478
C -2.215369 -2.144654 0.306458
C -1.846854 -1.029395 -0.671701
C -2.415637 -3.494161 -0.424855
C -2.797590 -4.633787 0.543691
C 1.632521 1.523105 -0.181904
C 2.127716 0.121495 0.061051
C -1.586105 4.119260 0.616550
C 3.303833 -0.348475 -0.581010
C 1.438889 -0.745140 0.950202
C 3.781328 -1.656094 -0.343768
C 1.917842 -2.052122 1.190210
C -1.385263 4.665472 2.026609
C 3.089381 -2.512619 0.544432
H -3.140253 -1.864251 0.844947
H -1.413269 -2.246542 1.062268
H -2.651872 -0.864694 -1.415424
H -0.896553 -1.245336 -1.197159
H -3.206087 -3.383927 -1.194623
H -1.485514 -3.762900 -0.965046
H 1.031648 1.921123 0.651916
H 2.450434 2.227447 -0.407239
H -2.010168 -4.789639 1.305056
H -3.738970 -4.403204 1.076577
H -2.939022 -5.587822 0.004011
H -2.621441 4.264752 0.255877
H -0.885778 4.576833 -0.109188
H 3.844668 0.313493 -1.268863
H 0.525374 -0.392233 1.442902
H 4.691621 -2.004756 -0.844305
H 1.382559 -2.708660 1.885935
H -0.351862 4.495121 2.373468
H -2.077579 4.178669 2.733692
H -1.581815 5.753574 2.034905
H 3.461421 -3.525783 0.733739


