%chk=000109962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000109962

0 1
 S   8.2000000E-03 -0.9245000      0.8972000    
 F  -0.7246000      0.1671000      -1.338500    
 F  -0.7148000      -2.003800      -1.331500    
 F   -3.141300      -1.104700      -1.498600    
 F   -2.791300      -2.088200      0.4065000    
 F   -2.688600      0.3046000       1.692900    
 F   -4.495500     -7.8900002E-02  0.5521000    
 F   -3.630800       1.554200      -1.461200    
 F   -1.781800       1.963200     -0.3770000    
 F   -3.696300       2.501200      0.5021000    
 O  -0.1442000      -2.212900       1.545600    
 O  -0.2175000      0.3062000       1.629700    
 N    1.563200     -0.8731000      0.1876000    
 C   -1.017100     -0.9133000     -0.5684000    
 C   -2.512900     -0.9532000     -0.2958000    
 C   -3.168000      0.2134000      0.4274000    
 C    2.129300      0.4274000     -0.2128000    
 C   -3.061200       1.563600     -0.2373000    
 C    3.631000      0.3915000     -0.1471000    
 C    4.274300      0.7472000       1.031300    
 C    4.357100      3.4000000E-03  -1.265800    
 C    5.667500      0.7141000       1.092200    
 C    5.750200     -2.9999999E-02  -1.204900    
 C    6.405400      0.3254000     -2.5900001E-02
 H    1.837900      -1.668100     -0.4039000    
 H    1.762800       1.237400      0.4262000    
 H    1.804300      0.6575000      -1.234000    
 H    3.709000       1.049200       1.908500    
 H    3.856700     -0.2771000      -2.188400    
 H    6.177700      0.9901000       2.010300    
 H    6.324800     -0.3331000      -2.075300    
 H    7.490100      0.2992000      2.1600001E-02


%chk=000109962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000109962

0 1
S 0.098101 -0.253729 1.140949
F -1.004951 0.644477 -1.358229
F -0.417139 -1.558016 -1.304410
F -3.169107 -1.173655 -1.747424
F -2.593322 -2.226317 0.198015
F -3.041504 0.088598 1.672443
F -4.800266 -0.705104 0.437019
F -4.172123 1.404778 -1.535490
F -2.746732 2.252131 0.018669
F -4.932363 1.954757 0.529176
O -0.234136 -1.446605 2.174278
O -0.027110 1.319092 1.485964
N 1.744345 -0.525491 0.515084
C -1.117608 -0.543834 -0.620416
C -2.593942 -0.972904 -0.456312
C -3.559978 -0.035208 0.361703
C 2.393262 0.498938 -0.339308
C -3.849484 1.416598 -0.172632
C 3.901322 0.308443 -0.241626
C 4.553425 0.396595 1.015671
C 4.666755 0.059459 -1.407178
C 5.953511 0.246084 1.101264
C 6.070604 -0.086948 -1.321396
C 6.715947 0.005588 -0.067351
H 1.941060 -1.521293 0.343045
H 2.083144 1.483959 0.054944
H 2.064366 0.428794 -1.395179
H 3.958757 0.575865 1.918292
H 4.168126 -0.014933 -2.381437
H 6.451268 0.318182 2.074363
H 6.656099 -0.273514 -2.228166
H 7.803274 -0.109785 0.000474


