%chk=000053798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053798

0 1
 F   0.6282000       4.265900       1.968100    
 F   -2.223900      -4.818500       1.238900    
 N  -0.3739000       1.066100      -1.474000    
 N    2.841500     -0.6251000     -0.5894000    
 N    5.563300     -0.8253000      0.3644000    
 C   -3.077300      0.5696000     -0.2401000    
 C   -3.440700      0.7501000      -1.730000    
 C    1.018300      0.6649000      -1.625500    
 C   -1.156800       1.260300      -2.688800    
 C   -2.361600      0.3362000      -2.724600    
 C    1.443300     -0.2189000     -0.4621000    
 C   -2.045200       1.584900      0.2566000    
 C  -0.7708000       1.771800     -0.3359000    
 C    3.728500      0.5445000     -0.5654000    
 C    3.209300      -1.568700      0.4732000    
 C    5.195100      0.1198000     -0.6969000    
 C    4.675600      -1.994300      0.3408000    
 C   -2.846200     -0.8889000      0.1604000    
 C   -2.378200       2.315300       1.420100    
 C   0.1128000       2.688100      0.2777000    
 C    6.961100      -1.232300      0.2352000    
 C   -1.487900       3.219200       1.992900    
 C  -0.2399000       3.405100       1.421300    
 C   -1.956700      -1.190600       1.186600    
 C   -3.527700      -1.903600     -0.5046000    
 C   -1.746200      -2.520300       1.551700    
 C   -3.317400      -3.233400     -0.1395000    
 C   -2.426600      -3.541800      0.8887000    
 H   -4.015200      0.8223000      0.2805000    
 H   -3.682700       1.808700      -1.902900    
 H   -4.368500      0.2200000      -1.973100    
 H    1.134700      8.0300003E-02  -2.548200    
 H    1.624400       1.563100      -1.763800    
 H  -0.5425000       1.043100      -3.571800    
 H   -1.459400       2.310500      -2.795200    
 H   -2.050600     -0.7028000      -2.573900    
 H   -2.797000      0.3857000      -3.730600    
 H    1.285900      0.2663000      0.5079000    
 H   0.8062000      -1.113600     -0.4654000    
 H    3.590800       1.126000      0.3563000    
 H    3.545100       1.213500      -1.410100    
 H    2.583200      -2.466700      0.4056000    
 H    3.041500      -1.127600       1.465300    
 H    5.365000     -0.3205000      -1.689000    
 H    5.822100       1.017000     -0.6263000    
 H    4.917900      -2.660600       1.177700    
 H    4.810400      -2.570200     -0.5849000    
 H   -3.345300       2.174500       1.898700    
 H    1.098800       2.881000     -0.1382000    
 H    7.243800      -1.901700       1.055200    
 H    7.622400     -0.3610000      0.2988000    
 H    7.158000      -1.746000     -0.7128000    
 H   -1.767700       3.768600       2.886500    
 H   -1.413400     -0.4295000       1.736100    
 H   -4.246800      -1.714300      -1.292600    
 H   -1.053700      -2.761100       2.352900    
 H   -3.850300      -4.029000     -0.6519000    


%chk=000053798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053798

0 1
F 0.527838 4.365025 1.950816
F -2.047348 -4.651261 1.679621
N -0.434745 0.987315 -1.433919
N 2.940947 -0.548650 -0.540858
N 5.672314 -1.081427 0.279601
C -3.228764 0.646655 -0.315759
C -3.585548 0.709466 -1.831894
C 1.002194 0.649813 -1.558844
C -1.200847 1.110203 -2.705431
C -2.473155 0.243790 -2.788520
C 1.494963 -0.255505 -0.404485
C -2.222039 1.710466 0.140453
C -0.866855 1.780565 -0.337728
C 3.807627 0.527889 0.004259
C 3.328913 -1.857547 0.044662
C 5.286470 0.229574 -0.292434
C 4.806591 -2.158026 -0.256315
C -2.857210 -0.775297 0.173332
C -2.614797 2.582701 1.185063
C 0.042683 2.672109 0.304021
C 7.107947 -1.371297 0.109089
C -1.728830 3.488809 1.810403
C -0.404397 3.487339 1.349754
C -1.979521 -0.966734 1.272236
C -3.465651 -1.927034 -0.394796
C -1.699992 -2.253408 1.783196
C -3.204724 -3.224495 0.098175
C -2.320004 -3.358409 1.179841
H -4.175599 0.897121 0.209548
H -3.858824 1.756857 -2.069518
H -4.497989 0.109022 -2.013639
H 1.136698 0.085362 -2.496552
H 1.649578 1.552200 -1.646957
H -0.520958 0.818818 -3.525858
H -1.476508 2.173991 -2.877562
H -2.204150 -0.809388 -2.586031
H -2.852006 0.291668 -3.829635
H 1.254977 0.209192 0.582158
H 0.929260 -1.203549 -0.453032
H 3.675385 0.630555 1.110856
H 3.532770 1.491428 -0.463347
H 2.695248 -2.646755 -0.400539
H 3.179724 -1.874234 1.153373
H 5.443246 0.257415 -1.401768
H 5.918931 1.014812 0.163152
H 5.092385 -3.114017 0.221554
H 4.930654 -2.272685 -1.364218
H -3.646807 2.523205 1.551081
H 1.081143 2.760654 -0.024085
H 7.355814 -2.327281 0.604743
H 7.707565 -0.574560 0.585287
H 7.422567 -1.446371 -0.963475
H -2.040514 4.142429 2.628625
H -1.504398 -0.098684 1.739068
H -4.159855 -1.824959 -1.234901
H -1.022565 -2.398394 2.629973
H -3.672731 -4.110381 -0.341237


