%chk=000127796.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127796

0 1
 S   -1.432700      -2.331800     -2.0900000E-02
 F   -1.973700       2.727100     -4.2399999E-02
 O    3.017700       2.316300     -8.8799998E-02
 O    5.343100       1.313200      0.5678000    
 O    5.756000     -0.6812000     -0.4725000    
 N   -2.976600      0.2012000     -2.7000001E-03
 N    1.653700      -1.523200      7.8400001E-02
 N   -5.826200      6.1999999E-02  9.6199997E-02
 C   -1.589100      0.3841000     -1.6000000E-03
 C   -3.666000      0.1345000       1.293100    
 C   -3.776200      0.7084000      -1.123200    
 C   0.6977000     -0.4802000      3.1099999E-02
 C  -0.6963000     -0.7014000      1.2600000E-02
 C   -5.018800     -0.5607000       1.144200    
 C   -5.125900     -6.2000002E-03  -1.185100    
 C    1.197400      -2.895800      0.3251000    
 C    1.145600      0.8639000     -1.4300000E-02
 C   1.6300000E-02  -3.273000     -0.5470000    
 C   -1.119400       1.693900     -2.4000000E-02
 C   0.2474000       1.937900     -3.8199998E-02
 C    3.002600      -1.212800      6.1799999E-02
 C    2.602000       1.165200     -3.9299998E-02
 C    3.532200      1.3000000E-02 -3.9999999E-04
 C    4.989300      0.1455000     -9.8999999E-03
 H   -3.805200       1.151400       1.682200    
 H   -3.065600     -0.4155000       2.027800    
 H   -3.248300      0.5469000      -2.071200    
 H   -3.939400       1.787300      -1.012400    
 H   -4.875400      -1.625600      0.9220000    
 H   -5.559700     -0.5020000       2.095000    
 H   -5.745700      0.4613000      -1.958000    
 H   -4.985000      -1.054300      -1.477900    
 H   0.9697000      -3.024300       1.391900    
 H    2.007900      -3.602000      0.1021000    
 H   -6.715800     -0.4304000      1.9900000E-02
 H   0.2199000      -3.074500      -1.604800    
 H  -0.2095000      -4.338500     -0.4405000    
 H   0.5943000       2.967000     -6.6299997E-02
 H    3.634800      -2.093900      0.1161000    
 H    6.315900       1.438400      0.5802000    


%chk=000127796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127796

0 1
S -1.530813 -2.257537 0.019254
F -1.918175 2.917340 -0.230693
O 3.073571 2.435749 -0.287531
O 5.610557 1.272009 -0.214345
O 5.716299 -1.006772 0.167461
N -3.037460 0.289326 -0.006890
N 1.606660 -1.444398 0.283460
N -5.834712 -0.213499 0.019949
C -1.643836 0.506327 -0.025576
C -3.697720 -0.220934 1.226892
C -3.947105 1.102421 -0.853918
C 0.673990 -0.383446 0.099053
C -0.738725 -0.597258 0.065925
C -4.942010 -1.047848 0.852342
C -5.177581 0.248354 -1.221894
C 1.151883 -2.817222 0.623875
C 1.202397 0.934001 -0.087978
C 0.022993 -3.277343 -0.298794
C -1.057080 1.799119 -0.173968
C 0.310878 2.021089 -0.237178
C 2.954062 -1.196787 0.235265
C 2.672682 1.238990 -0.127209
C 3.533207 0.053405 0.030526
C 5.016204 0.035401 0.006481
H -4.012932 0.637427 1.859881
H -2.987316 -0.837869 1.802020
H -3.411945 1.407416 -1.768420
H -4.286986 2.013863 -0.321302
H -4.600103 -1.974901 0.330607
H -5.476221 -1.341486 1.774386
H -5.887925 0.871396 -1.795568
H -4.838753 -0.593863 -1.873724
H 0.811862 -2.846661 1.676440
H 2.023215 -3.487070 0.524602
H -6.751039 -0.646134 -0.145659
H 0.305171 -3.190827 -1.360152
H -0.264676 -4.316182 -0.072625
H 0.733479 3.023679 -0.352789
H 3.618173 -2.056371 0.373426
H 6.598832 1.138296 -0.209532


