%chk=000063289.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063289

0 1
 S   -1.206100      -1.261400      -1.158800    
 F   0.8919000       3.007300       1.786400    
 O   0.3733000      -4.194800     -0.8943000    
 O   -4.281200       2.563200      0.2369000    
 N    3.887500     -0.9650000      9.7000003E-02
 N    1.589900      -2.594300      0.2667000    
 N   -2.824500      0.8018000     -0.3252000    
 N   -3.684700      -1.426100     -0.4039000    
 C    2.598300     -0.3558000      0.4514000    
 C    3.819400      -2.204600     -0.6935000    
 C    1.678700      -1.391900       1.097500    
 C    2.882300      -3.208600     -2.6100000E-02
 C    5.015200     -0.1521000     -6.4800002E-02
 C   0.4146000      -3.167100     -0.2132000    
 C    5.881300      0.1608000       1.011400    
 C    5.335100      0.3955000      -1.330300    
 C  -0.8708000      -2.461700      0.1377000    
 C    7.000900      0.9731000      0.8315000    
 C    5.598600     -0.3862000       2.372800    
 C    6.454700       1.207600      -1.510200    
 C    7.287500       1.496600     -0.4293000    
 C   -2.712200     -0.5821000     -0.5465000    
 C   -5.187300      0.4183000      0.1655000    
 C   -4.068300       1.373600      1.4200000E-02
 C   -4.941600     -0.9422000     -2.5800001E-02
 C   -1.699900       1.694000     -0.3874000    
 C   -6.464500      0.8702000      0.5186000    
 C   -5.993500      -1.850800      0.1410000    
 C  -0.9391000       1.917200      0.7527000    
 C   -1.389700       2.322300      -1.586200    
 C   -7.503100     -4.5600001E-02  0.6810000    
 C   -7.268100      -1.405500      0.4936000    
 C   0.1518000       2.784500      0.6926000    
 C  -0.2989000       3.189500      -1.646200    
 C   0.4720000       3.420500     -0.5069000    
 H    2.132100      4.8500001E-02 -0.4557000    
 H    2.741900      0.4773000       1.149500    
 H    4.813200      -2.659100     -0.7882000    
 H    3.457200      -1.972700      -1.702900    
 H   0.7166000     -0.9216000       1.290400    
 H    2.085900      -1.704900       2.066700    
 H    3.303200      -3.547200      0.9285000    
 H    2.764200      -4.089400     -0.6649000    
 H    4.697000      0.1896000      -2.187400    
 H  -0.8777000      -2.031200       1.139500    
 H   -1.663600      -3.219100      0.1346000    
 H    7.659700       1.209300       1.663000    
 H    5.473700      -1.473700       2.335400    
 H    6.418100     -0.1828000       3.070700    
 H    4.692000      6.7500003E-02   2.785900    
 H    6.677200       1.616600      -2.491500    
 H    8.158800       2.129600     -0.5694000    
 H   -6.668600       1.925900      0.6736000    
 H   -5.825600      -2.915000     -7.1000000E-03
 H   -1.180300       1.425200       1.690800    
 H   -1.985000       2.148800      -2.478500    
 H   -8.495100      0.3015000      0.9552000    
 H   -8.076800      -2.119400      0.6198000    
 H  -4.9500000E-02   3.684700      -2.580100    
 H    1.321700       4.095000     -0.5534000    


%chk=000063289-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000063289

0 1
S -0.952187 -0.546035 -2.322818
F 0.929094 4.528198 -2.146182
O 1.029406 -3.478720 -3.324023
O -3.419106 2.852733 0.549818
N 3.431788 -1.368444 0.380477
N 1.441786 -2.768682 -1.144658
N -2.311798 1.183609 -0.681825
N -2.301246 -1.118219 0.010424
C 2.006767 -0.950712 0.437063
C 3.772137 -1.951389 -0.938256
C 1.082481 -2.153718 0.148370
C 2.864335 -3.164415 -1.228604
C 4.396117 -0.501260 0.999787
C 0.619601 -2.931369 -2.248887
C 4.391996 -0.327781 2.423756
C 5.394780 0.151706 0.223702
C -0.829942 -2.445103 -2.163891
C 5.362471 0.526757 3.001293
C 3.428455 -1.084867 3.320755
C 6.360627 0.984155 0.826982
C 6.340013 1.187757 2.223884
C -1.957789 -0.166349 -0.830875
C -3.504455 0.560889 1.372151
C -3.113313 1.635545 0.440625
C -3.084061 -0.786207 1.129527
C -1.878233 2.189478 -1.643941
C -4.294271 0.867136 2.510608
C -3.466058 -1.809872 2.038784
C -0.663890 2.871510 -1.416100
C -2.683538 2.476079 -2.767411
C -4.664964 -0.152624 3.402781
C -4.248249 -1.492547 3.162191
C -0.279576 3.839761 -2.356498
C -2.259323 3.458396 -3.689199
C -1.044318 4.153088 -3.493181
H 1.802083 -0.149462 -0.312810
H 1.778666 -0.544907 1.434780
H 4.824649 -2.284103 -0.920156
H 3.654144 -1.213371 -1.767524
H 0.028085 -1.838938 0.157484
H 1.224687 -2.908102 0.949226
H 3.063297 -3.958279 -0.482291
H 3.045027 -3.562169 -2.240269
H 5.407164 0.023246 -0.863390
H -1.360117 -2.686216 -1.225335
H -1.366417 -2.856881 -3.029289
H 5.364435 0.652498 4.091487
H 3.177554 -2.066250 2.878759
H 3.875575 -1.249073 4.316632
H 2.476980 -0.539340 3.482336
H 7.115517 1.479331 0.205654
H 7.080923 1.836276 2.703695
H -4.597686 1.907655 2.665645
H -3.140680 -2.834789 1.836713
H -0.045402 2.669273 -0.537611
H -3.625737 1.939197 -2.910487
H -5.273868 0.080267 4.282274
H -4.542031 -2.285081 3.859192
H -2.876222 3.686481 -4.563735
H -0.696360 4.917853 -4.193210


