%chk=000050980.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050980

0 1
 F    4.545200       2.712800      0.7648000    
 F    3.250200       4.066200       1.869600    
 O   -2.957700     -0.5958000      0.6333000    
 O   -3.227400     -0.2085000      -1.624500    
 O    2.514000       3.166000     -7.3399998E-02
 O    1.804800      -1.988900       1.017400    
 N   -4.153600      -3.183900       2.484700    
 C   -2.953000       1.659700     -8.2000002E-02
 C   -3.866900       2.533800     -0.9883000    
 C   -1.487700       2.063700     -7.9400003E-02
 C   -5.328400       2.066600     -0.9429000    
 C   -3.814600       4.010700     -0.5690000    
 C   -3.059600      0.1903000     -0.4788000    
 C  -0.8765000       2.465200       1.108600    
 C  -0.7541000       2.032800      -1.265200    
 C   -3.060500      -2.004400      0.4034000    
 C   0.4682000       2.835800       1.110500    
 C   0.5906000       2.403400      -1.263400    
 C    1.201700       2.804800     -7.5499997E-02
 C   -1.689300      -2.558900      9.4800003E-02
 C  -0.5616000      -2.011800      0.7070000    
 C   -1.551100      -3.617800     -0.8026000    
 C   0.7042000      -2.523600      0.4217000    
 C   -3.669500      -2.664100       1.567000    
 C  -0.2853000      -4.129500      -1.087900    
 C   0.8424000      -3.582300     -0.4758000    
 C    3.253700       2.936600       1.120000    
 C    2.908700      -1.734800      0.2206000    
 C    2.746400      -1.118200      -1.020000    
 C    4.182700      -2.096400      0.6582000    
 C    3.858100     -0.8633000      -1.823000    
 C    5.294500      -1.841300     -0.1446000    
 C    5.132000      -1.224800      -1.385300    
 H   -3.351700       1.742000      0.9398000    
 H   -3.532300       2.469000      -2.031700    
 H   -5.713400       2.074900      8.2599998E-02
 H   -5.450300       1.055900      -1.342100    
 H   -5.963700       2.725900      -1.544700    
 H   -4.114000       4.136600      0.4771000    
 H   -2.809300       4.426200     -0.6889000    
 H   -4.488400       4.613600      -1.187500    
 H   -1.437100       2.499300       2.038800    
 H   -1.210900       1.722400      -2.200800    
 H   -3.727500      -2.188600     -0.4499000    
 H   0.8995000       3.166800       2.050400    
 H    1.157600       2.375700      -2.189800    
 H  -0.6497000      -1.193000       1.416700    
 H   -2.421600      -4.054500      -1.284900    
 H  -0.1784000      -4.957400      -1.782700    
 H    1.813400      -4.016200     -0.6996000    
 H    2.915300       2.076400       1.708700    
 H    1.768000     -0.8060000      -1.375800    
 H    4.314700      -2.577300       1.623500    
 H    3.732200     -0.3778000      -2.786400    
 H    6.286600      -2.122600      0.1963000    
 H    5.997800      -1.024800      -2.009700    


%chk=000050980-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050980

0 1
F 4.643321 2.755634 -0.937077
F 3.415356 3.962018 0.557209
O -3.137921 -0.658031 0.740551
O -3.670381 -0.266799 -1.498901
O 2.415381 2.804189 -1.221560
O 1.760052 -2.519735 1.128104
N -3.804253 -3.350626 2.704710
C -3.117269 1.635245 0.012132
C -4.114912 2.589854 -0.721548
C -1.641127 1.937227 -0.287491
C -5.577750 2.236632 -0.363264
C -3.811813 4.065263 -0.374538
C -3.364501 0.175527 -0.369946
C -0.768837 2.357014 0.743381
C -1.127766 1.811814 -1.605809
C -3.113065 -2.140101 0.433918
C 0.587085 2.660623 0.483732
C 0.222867 2.095593 -1.883536
C 1.068653 2.512334 -0.834391
C -1.736099 -2.541734 -0.076926
C -0.597688 -2.353692 0.740483
C -1.597803 -3.057288 -1.386594
C 0.675427 -2.675011 0.233178
C -3.493553 -2.794933 1.697058
C -0.314827 -3.400415 -1.870034
C 0.830149 -3.213108 -1.067650
C 3.416285 2.761068 -0.242068
C 3.011200 -2.021499 0.677887
C 3.138023 -1.107596 -0.395452
C 4.134518 -2.420910 1.434488
C 4.420394 -0.604820 -0.716392
C 5.406506 -1.904289 1.105446
C 5.556769 -0.998478 0.028365
H -3.277461 1.721665 1.102802
H -3.978121 2.441391 -1.811282
H -5.755098 2.343512 0.724328
H -5.836991 1.204521 -0.658983
H -6.274910 2.917525 -0.884200
H -3.930304 4.247645 0.711289
H -2.785793 4.356589 -0.659316
H -4.515398 4.732949 -0.903955
H -1.150037 2.463478 1.765236
H -1.783071 1.471874 -2.415515
H -3.877207 -2.339420 -0.341542
H 1.229310 3.034127 1.286531
H 0.632171 1.999507 -2.893386
H -0.683625 -1.950376 1.754182
H -2.479212 -3.179391 -2.024641
H -0.204004 -3.814525 -2.877500
H 1.823875 -3.483413 -1.437970
H 3.364024 1.896959 0.444350
H 2.258146 -0.793150 -0.966431
H 3.994591 -3.121300 2.263221
H 4.529921 0.097935 -1.549546
H 6.280056 -2.212327 1.690145
H 6.544114 -0.600146 -0.225884


