%chk=000001701.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001701

0 1
 S    2.931400     -3.1000001E-03  0.2497000    
 F    3.626200     -9.9999997E-05  -1.178800    
 O    3.292700       1.266000      0.8511000    
 O    3.289600      -1.276100      0.8444000    
 N   -5.250300     -1.7899999E-02  0.4629000    
 C   -1.554800      5.7999999E-03 -0.4182000    
 C   -3.030000      8.8000000E-03 -0.6381000    
 C   -3.808800      6.0999999E-03  0.6863000    
 C  -0.8629000       1.212300     -0.3122000    
 C  -0.8671000      -1.203800     -0.3188000    
 C    1.204600     -3.0000001E-04 -7.6000001E-03
 C   0.5167000       1.209200     -0.1071000    
 C   0.5126000      -1.206900     -0.1135000    
 H   -3.312800      0.8843000      -1.237700    
 H   -3.313100     -0.8641000      -1.241600    
 H   -3.557000      0.8939000       1.277600    
 H   -3.531800     -0.8660000       1.289600    
 H   -1.387400       2.161200     -0.3877000    
 H   -1.395000      -2.150400     -0.3993000    
 H    1.035000       2.161100     -3.4400001E-02
 H    1.027700      -2.160900     -4.5899998E-02
 H   -5.495400     -0.8396000     -8.8600002E-02
 H   -5.520300      0.7868000     -0.1018000    


%chk=000001701-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001701

0 1
S 3.013800 0.001474 0.384850
F 3.630128 0.006426 -1.371783
O 3.474922 1.409333 1.011663
O 3.476529 -1.409074 1.004403
N -5.305653 -0.002693 0.492566
C -1.556384 0.000984 -0.517969
C -3.053139 0.000596 -0.739543
C -3.850564 -0.002699 0.623188
C -0.847054 1.224612 -0.370378
C -0.845752 -1.222491 -0.375555
C 1.184424 0.001303 0.022906
C 0.537589 1.241866 -0.102892
C 0.538916 -1.239400 -0.108180
H -3.364448 0.893383 -1.314434
H -3.363314 -0.890193 -1.318145
H -3.545038 0.882292 1.212418
H -3.544601 -0.890124 1.208554
H -1.380952 2.175624 -0.476477
H -1.378636 -2.173615 -0.485683
H 1.089640 2.179923 0.009912
H 1.091989 -2.177326 0.000643
H -5.726101 -0.855593 0.118198
H -5.726501 0.851694 0.122035


