%chk=000045242.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045242

0 1
 I    3.837800       3.087100     -0.1538000    
 F    5.669500      0.5467000      0.5449000    
 O  -0.4476000     -0.2716000     -9.8999999E-02
 O   0.2139000      -2.323500     -0.9062000    
 N   -4.095600      0.2552000     -7.5599998E-02
 C   -2.679700      0.5560000      0.1335000    
 C   -4.922900       1.398800      0.3068000    
 C   -4.483300     -0.9329000      0.6839000    
 C   -1.812200     -0.6136000     -0.3034000    
 C   -4.533700       2.643100     -0.4730000    
 C   -5.936500      -1.296400      0.4306000    
 C   0.4652000      -1.221400     -0.4441000    
 C    1.846500     -0.7439000     -0.1819000    
 C    2.114300      0.6068000     -0.2709000    
 C    2.819900      -1.666700      0.1419000    
 C    3.412300       1.054400     -2.5200000E-02
 C    4.118000      -1.219200      0.3876000    
 C    4.414100      0.1412000      0.3041000    
 H   -2.464500      0.8090000       1.180500    
 H   -2.350500       1.412600     -0.4648000    
 H   -5.973800       1.213100      6.1900001E-02
 H   -4.864800       1.606000       1.382800    
 H   -3.927200      -1.814700      0.3556000    
 H   -4.310700     -0.8101000       1.760400    
 H   -1.977500     -0.8416000      -1.363500    
 H   -1.991900      -1.510300      0.2953000    
 H   -3.603900       3.092000     -0.1104000    
 H   -4.439900       2.440100      -1.545400    
 H   -5.311400       3.406300     -0.3545000    
 H   -6.631400     -0.6235000      0.9423000    
 H   -6.172800      -1.306700     -0.6390000    
 H   -6.136600      -2.302100      0.8179000    
 H    1.339700       1.319500     -0.5412000    
 H    2.600900      -2.727900      0.2132000    
 H    4.897900      -1.929800      0.6448000    


%chk=000045242-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045242

0 1
I 4.016644 2.522298 2.039411
F 5.902503 0.248577 0.693147
O -0.420816 -0.143748 -0.043575
O 0.184010 -2.045489 -1.249141
N -4.126295 0.338386 0.213682
C -2.682616 0.624020 0.395681
C -4.960653 1.558087 0.047998
C -4.657620 -0.615730 1.225659
C -1.855861 -0.427992 -0.353041
C -4.792471 2.213373 -1.335689
C -5.870877 -1.418645 0.719446
C 0.507082 -1.042901 -0.564938
C 1.910526 -0.671759 -0.213620
C 2.203659 0.478236 0.564457
C 2.959461 -1.504216 -0.681017
C 3.541207 0.796338 0.874193
C 4.296437 -1.192902 -0.374791
C 4.567446 -0.047768 0.397773
H -2.380380 0.639531 1.469164
H -2.446950 1.620653 -0.016914
H -6.017417 1.258501 0.168130
H -4.751480 2.308765 0.851730
H -3.847198 -1.325889 1.476209
H -4.919771 -0.090349 2.178716
H -2.010433 -0.362673 -1.443534
H -2.090562 -1.457715 -0.029220
H -3.753095 2.546421 -1.511337
H -5.058118 1.494733 -2.130236
H -5.446191 3.101013 -1.424959
H -6.726083 -0.764016 0.472467
H -5.600965 -1.982204 -0.190444
H -6.210148 -2.132853 1.492757
H 1.382702 1.106712 0.916187
H 2.706530 -2.384426 -1.279416
H 5.129391 -1.812368 -0.718838


