%chk=000023647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023647

0 1
 S   0.7264000      -2.694900      6.6000000E-03
 F   -5.406200      1.6200000E-02  3.3900000E-02
 F   -4.345500       1.585700       1.100800    
 F   -4.338700       1.557400      -1.079400    
 O    3.987900       2.731700      0.5762000    
 O    2.009400       2.770700     -0.5420000    
 N   0.6378000      0.4289000     -1.3300000E-02
 C  -0.6029000     -0.2274000      3.0000001E-04
 C    1.913700     -0.1562000     -1.8400000E-02
 C  -0.7040000      -1.627500      1.0200000E-02
 C    2.094000      -1.548100     -1.0900000E-02
 C   -1.780800      0.5392000      3.8000001E-03
 C    3.046200      0.6759000     -3.1300001E-02
 C   -3.034700     -7.0900001E-02  1.7600000E-02
 C   -1.970000      -2.233100      2.3800001E-02
 C   -3.129000      -1.457600      2.7500000E-02
 C    3.392300      -2.081100     -1.7200001E-02
 C    4.332700      0.1377000     -3.7400000E-02
 C    4.505500      -1.241400     -3.0500000E-02
 C   -4.270600      0.7634000      2.0800000E-02
 C    2.936300       2.131300     -4.1200001E-02
 H   0.5933000       1.440500     -1.2000000E-02
 H   -1.716200       1.626100     -4.0000002E-03
 H   -2.069700      -3.316500      3.1700000E-02
 H   -4.093900      -1.956800      3.8100000E-02
 H    3.553600      -3.157200     -1.2700000E-02
 H    5.221600      0.7624000     -6.4800002E-02
 H    5.505200      -1.665600     -3.9200000E-02
 H    3.908000       3.709400      0.5664000    


%chk=000023647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023647

0 1
S 0.730081 -2.779619 -0.055980
F -5.478428 0.052188 0.021308
F -4.322230 1.635382 1.165881
F -4.334290 1.664740 -1.093741
O 4.115758 2.855941 0.095042
O 1.806229 2.781260 0.069739
N 0.638442 0.406598 0.012457
C -0.602362 -0.254129 0.000854
C 1.910093 -0.161729 0.013583
C -0.724138 -1.671887 -0.027665
C 2.120216 -1.573877 -0.011359
C -1.781283 0.527994 0.018445
C 3.074451 0.690329 0.041421
C -3.052653 -0.088217 0.006995
C -1.995957 -2.276816 -0.037836
C -3.169508 -1.493414 -0.021428
C 3.415089 -2.112318 -0.007454
C 4.381558 0.121069 0.043332
C 4.555762 -1.266562 0.019423
C -4.271471 0.784549 0.024634
C 2.912414 2.149997 0.069116
H 0.647078 1.445231 0.031500
H -1.697633 1.620087 0.041364
H -2.075215 -3.368642 -0.059187
H -4.153366 -1.968313 -0.030191
H 3.545344 -3.200231 -0.026516
H 5.238794 0.797962 0.064673
H 5.557794 -1.704338 0.021985
H 3.911134 3.828964 0.113005


