%chk=000129799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129799

0 1
 F   -3.840700     -0.4570000       1.748400    
 F   -5.899000     -0.4474000       1.027100    
 F   -5.008000       1.382200       1.806500    
 O    2.541300       1.310400     -0.2716000    
 O   0.4960000      0.4460000     -0.9753000    
 O    3.911700      -2.458300      0.7444000    
 O    4.874300     -0.2723000     -0.6669000    
 O    4.008300       3.640500      0.8046000    
 O   0.1473000      -2.439500      -1.683800    
 O   -4.943000       1.290500      -1.095000    
 N    1.051200      -2.013600      0.4184000    
 N   -2.998900      0.1199000     -0.5699000    
 C    2.073200      -1.073600      6.5000001E-03
 C    3.296700      -1.184900      0.9232000    
 C    4.310700     -7.6600000E-02  0.6317000    
 C    3.616400       1.287300      0.6738000    
 C    1.517500      0.3581000      1.7600000E-02
 C    4.560300       2.430000      0.3184000    
 C  -0.3633000       1.549100     -0.7345000    
 C   0.1763000      -2.614600     -0.4685000    
 C   -1.443900       1.572400      -1.808800    
 C   -2.301100      0.3135000      -1.811500    
 C  -0.7657000      -3.566000      0.2194000    
 C   -4.266000      0.6266000     -0.3151000    
 C   -4.751700      0.2775000       1.060800    
 H    2.364900      -1.341200      -1.017900    
 H    2.979200      -1.118800       1.972000    
 H    5.133800     -0.1292000       1.353500    
 H    3.197000       1.463900       1.673300    
 H    1.090200      0.5766000       1.006700    
 H    5.535400       2.297800      0.7979000    
 H    4.693100       2.526600     -0.7641000    
 H   0.9418000      -2.194500       1.412400    
 H    4.682800      -2.496400       1.335600    
 H    5.633800      0.3279000     -0.7550000    
 H  -0.8137000       1.472500      0.2617000    
 H   0.2115000       2.481100     -0.7830000    
 H   -2.076400       2.455400      -1.660500    
 H  -0.9709000       1.665700      -2.793800    
 H    4.627700       4.352900      0.5713000    
 H   -3.036100      0.3793000      -2.621600    
 H   -1.696000     -0.5784000      -1.992800    
 H   -1.344200      -3.031400      0.9783000    
 H   -1.455400      -3.996200     -0.5120000    
 H  -0.1981000      -4.372200      0.6922000    
 H   -2.530300     -0.4155000      0.1556000    


%chk=000129799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129799

0 1
F -3.746378 -1.763627 0.476865
F -5.729971 -1.223607 -0.486199
F -4.940186 0.004160 1.247679
O 2.641362 1.410513 -0.162013
O 0.452362 0.748469 -0.575634
O 3.758575 -2.569174 0.663404
O 4.596125 -0.435289 -1.030863
O 4.223453 3.673251 0.428293
O -0.705021 -2.007387 -0.546598
O -4.486805 1.330968 -1.312898
N 0.953887 -1.779979 1.078449
N -2.601981 -0.067160 -1.289539
C 1.905144 -0.948736 0.318215
C 3.322085 -1.200351 0.922361
C 4.367552 -0.188743 0.405035
C 3.873474 1.245699 0.655860
C 1.511263 0.561487 0.338006
C 4.825632 2.359528 0.204750
C -0.492417 1.859567 -0.302078
C -0.232871 -2.305147 0.595416
C -1.297543 2.083935 -1.586094
C -1.825199 0.771534 -2.221741
C -0.948716 -3.271797 1.532246
C -3.861399 0.300100 -0.926631
C -4.564233 -0.666839 0.065810
H 1.882267 -1.260922 -0.743934
H 3.270320 -1.122472 2.027455
H 5.338676 -0.384633 0.891074
H 3.625783 1.388403 1.730346
H 1.266366 0.895318 1.374250
H 5.743468 2.344118 0.815910
H 5.102138 2.210341 -0.858846
H 1.310625 -2.184203 1.947622
H 4.110203 -2.583399 -0.268056
H 3.884872 0.057943 -1.525408
H -1.150417 1.554188 0.536111
H 0.063739 2.773951 -0.017826
H -2.145926 2.756172 -1.361655
H -0.660616 2.583083 -2.339885
H 3.352294 3.679415 -0.047045
H -2.463902 1.034041 -3.084382
H -0.978648 0.158612 -2.566128
H -0.445845 -3.402276 2.505562
H -1.977787 -2.914167 1.701904
H -1.024786 -4.255383 1.036903
H -2.131015 -0.923404 -0.936373


