%chk=000105447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105447

0 1
 S   0.1764000      3.1900000E-02  0.2745000    
 F  -0.7470000      -2.087100     -0.8924000    
 F   -1.770400      -1.549100      0.9446000    
 F   -3.226600      -1.280100      -1.288000    
 F   -1.724400     -1.7000001E-02  -2.219500    
 F   -3.868300       1.297700      -1.427600    
 F   -2.094100       1.911400     -0.3386000    
 F   -4.306700       1.894900       1.181900    
 F   -4.729400     -0.1860000      0.6858000    
 F   -2.944100      0.3292000       1.829200    
 O  -0.1795000      0.7462000       1.486400    
 O   0.5871000      0.7639000     -0.9088000    
 O    3.866400     -3.9999999E-02 -0.2406000    
 O    6.127800     -0.3641000      0.1068000    
 N    1.384800      -1.124200      0.6639000    
 C   -1.202200      -1.022800     -0.1712000    
 C   -2.271600     -0.3426000      -1.013500    
 C   -2.977900      0.8920000     -0.4757000    
 C    2.168400      -1.723600     -0.4437000    
 C    1.130800      -2.089000       1.761400    
 C   -3.739800      0.7229000      0.8154000    
 C    3.645100      -1.444500     -0.2315000    
 C    5.158500      0.3591000     -5.9599999E-02
 C    5.189500       1.835900     -9.7300000E-02
 C    6.347000       2.484900      5.8200002E-02
 H    1.988300      -2.802900     -0.5009000    
 H    1.857200      -1.302600      -1.405100    
 H   0.6361000      -1.590500       2.599600    
 H    2.077500      -2.490000       2.135500    
 H   0.5056000      -2.916300       1.414500    
 H    4.221300      -1.907700      -1.041100    
 H    3.982300      -1.860200      0.7252000    
 H    4.264300       2.379700     -0.2515000    
 H    6.369100       3.569300      3.0600000E-02
 H    7.288200       1.969300      0.2142000    


%chk=000105447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105447

0 1
S 0.368630 0.286487 0.084221
F -0.801442 -2.234853 -0.476239
F -1.697087 -1.266791 1.386515
F -3.534552 -1.718094 -0.773904
F -2.149683 -0.517510 -2.136940
F -4.375613 0.825013 -1.388837
F -2.449459 1.758959 -0.573106
F -4.923387 1.866957 0.980436
F -4.713478 -0.362689 1.335967
F -3.057413 1.057645 1.973347
O 0.200892 1.091546 1.472262
O 0.480722 1.002865 -1.358887
O 4.433851 -0.310893 -1.043893
O 4.907965 -0.517837 1.243223
N 1.795796 -0.839206 0.251222
C -1.352140 -1.043616 0.046585
C -2.585557 -0.650767 -0.797387
C -3.349597 0.677185 -0.430400
C 2.241755 -1.476050 -1.004465
C 1.854009 -1.582731 1.526086
C -4.016669 0.802426 0.991188
C 3.775266 -1.630685 -1.027475
C 4.937544 0.158777 0.185711
C 5.499736 1.518102 0.006138
C 6.068638 2.184790 1.044020
H 1.790487 -2.482139 -1.140031
H 1.933470 -0.829700 -1.845132
H 1.383890 -0.980161 2.321271
H 2.921659 -1.692770 1.787623
H 1.365560 -2.575738 1.463903
H 4.065069 -2.119079 -1.972597
H 4.145408 -2.216565 -0.168345
H 5.422064 1.947416 -0.997460
H 6.479428 3.191688 0.918435
H 6.123937 1.726014 2.038045


