%chk=000049962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049962

0 1
 F   -4.163100       2.646900      0.8439000    
 F   -3.595000       1.874900      -1.285700    
 O  -2.1100000E-02  -1.789300      0.1699000    
 O   -1.079100      -3.814800      0.5260000    
 O    3.192100       2.008500      0.3131000    
 N    1.790500      -3.763600       2.257700    
 C   -3.228200      -1.617100     -0.6457000    
 C   -2.413500     -0.4731000     -0.1178000    
 C   -2.342100      -1.812900      0.5424000    
 C   -4.706400      -1.550000     -0.4555000    
 C   -2.821300      -2.291900      -1.913500    
 C   -3.053000      0.6185000      0.6014000    
 C   -1.087300      -2.597200      0.4146000    
 C   -3.600700       1.708700      5.3500000E-02
 C    1.237900      -2.461600      3.1399999E-02
 C    2.301100      -1.480900     -0.3314000    
 C    1.541600      -3.193400       1.278100    
 C    2.248500     -0.1789000      0.1666000    
 C    3.348500      -1.865800      -1.168400    
 C    3.243300      0.7381000     -0.1724000    
 C    4.343100     -0.9486000      -1.507500    
 C    4.290500      0.3533000      -1.009600    
 C    1.972900       2.664100      0.2738000    
 C    1.209700       2.598800     -0.8778000    
 C    1.550000       3.367300       1.387100    
 C  -1.8400000E-02   3.259000     -0.9174000    
 C   0.3219000       4.027600       1.347600    
 C  -0.4624000       3.973400      0.1954000    
 H   -1.587200     -0.1439000     -0.7404000    
 H   -2.831300      -1.938200       1.504300    
 H   -5.156300      -2.534100     -0.6300000    
 H   -5.157900     -0.8486000      -1.165600    
 H   -5.000100      -1.249700      0.5563000    
 H   -3.379700      -1.879000      -2.761200    
 H   -3.031900      -3.365700      -1.864700    
 H   -1.758400      -2.164300      -2.145900    
 H   -3.077900      0.5477000       1.686700    
 H    1.129500      -3.176000     -0.7961000    
 H    1.450400      0.1071000      0.8474000    
 H    3.403000      -2.877200      -1.562300    
 H    5.158800      -1.248100      -2.159100    
 H    5.068100       1.063400      -1.277600    
 H    1.543000       2.068500      -1.765000    
 H    2.159000       3.409800       2.285000    
 H  -0.6277000       3.219900      -1.815600    
 H  -2.4100000E-02   4.583500       2.214100    
 H   -1.418500       4.487600      0.1644000    


%chk=000049962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000049962

0 1
F -5.231675 1.781999 1.289490
F -3.074487 1.960501 0.617553
O -0.287198 -1.827102 0.448655
O -0.973063 -3.901080 1.285162
O 3.112233 2.141626 -0.812280
N 1.514943 -1.584160 3.394623
C -3.032114 -2.030862 -1.132392
C -2.945372 -0.914793 -0.073429
C -2.628204 -2.381170 0.340280
C -4.399051 -2.547517 -1.578966
C -1.978871 -2.042563 -2.238079
C -4.134577 -0.222090 0.477194
C -1.264922 -2.810595 0.744554
C -4.147780 1.089310 0.778040
C 1.133351 -2.174750 0.817874
C 2.027702 -1.387864 -0.122727
C 1.336145 -1.844623 2.245191
C 2.141426 0.014171 0.030933
C 2.695050 -2.052193 -1.177639
C 2.909664 0.749180 -0.897333
C 3.485812 -1.304035 -2.081090
C 3.592672 0.095038 -1.950806
C 2.187545 2.978619 -0.120359
C 0.788889 2.856065 -0.287526
C 2.745896 4.010051 0.662413
C -0.061423 3.775417 0.366274
C 1.883921 4.929624 1.300957
C 0.481147 4.812619 1.161070
H -2.052092 -0.287860 -0.158419
H -3.396894 -2.924672 0.899006
H -4.303689 -3.565321 -1.999118
H -4.818995 -1.892415 -2.365095
H -5.130270 -2.597295 -0.753258
H -2.313486 -1.405908 -3.078221
H -1.834108 -3.067613 -2.628731
H -1.004412 -1.664665 -1.888451
H -5.062988 -0.772089 0.659339
H 1.261380 -3.267064 0.696313
H 1.639873 0.520098 0.861845
H 2.603288 -3.138139 -1.291194
H 4.015700 -1.812309 -2.893217
H 4.193763 0.692870 -2.642143
H 0.371803 2.065515 -0.919417
H 3.833454 4.077939 0.759338
H -1.146036 3.678555 0.250424
H 2.310130 5.732430 1.912252
H -0.183275 5.521818 1.665607


