%chk=000044014.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044014

0 1
 F   -5.145700     -0.4916000      0.3274000    
 N    1.905300      -2.479900      0.2366000    
 C    2.647500      0.3105000     -0.1067000    
 C   0.8160000       2.143300      0.1444000    
 C    1.276300     -0.2509000     -0.5880000    
 C   0.2358000      0.9208000     -0.6339000    
 C    2.549200      0.7625000       1.359700    
 C    3.008400       1.548600     -0.9522000    
 C    1.363000       1.719300       1.524300    
 C    2.010300       2.683600     -0.6758000    
 C   0.8601000      -1.470600      0.2451000    
 C   -1.213600      0.5410000     -0.3755000    
 C   -1.966100     -5.3700000E-02  -1.385800    
 C   -1.783800      0.7887000      0.8712000    
 C    2.180400      -2.932700      -1.130100    
 C    1.534800      -3.620300       1.079600    
 C   -3.295500     -0.4025000      -1.148100    
 C   -3.113200      0.4397000       1.108800    
 C   -3.869100     -0.1558000      9.9100001E-02
 H    3.449300     -0.4269000     -0.2165000    
 H   6.5700002E-02   2.933900      0.2587000    
 H    1.380300     -0.5628000      -1.635800    
 H   0.2160000       1.262100      -1.682900    
 H    3.476100       1.272100       1.652800    
 H    2.451300     -8.8500001E-02   2.042100    
 H    2.999200       1.291500      -2.018300    
 H    4.024700       1.889200     -0.7211000    
 H   0.6205000       1.239700       2.161400    
 H    1.694600       2.607800       2.076500    
 H    2.507000       3.493300     -0.1272000    
 H    1.666700       3.115300      -1.623300    
 H  -6.6699997E-02  -1.898600     -0.1579000    
 H   0.6348000      -1.169400       1.274500    
 H   -1.529600     -0.2544000      -2.360500    
 H   -1.263400       1.278900       1.679000    
 H    2.701000      -2.177100      -1.725600    
 H    1.271500      -3.243900      -1.658000    
 H    2.862500      -3.791800      -1.113400    
 H    2.349600      -4.351800       1.118400    
 H   0.6319000      -4.125500      0.7178000    
 H    1.359100      -3.294200       2.110800    
 H   -3.884000     -0.8674000      -1.933600    
 H   -3.563400      0.6384000       2.077000    


%chk=000044014-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044014

0 1
F -5.233148 -0.557340 0.246633
N 1.888629 -2.503330 0.191018
C 2.674800 0.348780 -0.234106
C 0.839767 2.134916 0.255679
C 1.287632 -0.202540 -0.688041
C 0.246470 1.003868 -0.643320
C 2.650763 0.674051 1.282277
C 2.986060 1.653609 -1.014070
C 1.417252 1.584223 1.591534
C 2.010836 2.782529 -0.534928
C 0.847805 -1.444490 0.127001
C -1.201826 0.598113 -0.355169
C -1.923998 -0.111744 -1.354817
C -1.882755 0.917509 0.848105
C 2.170779 -3.117434 -1.122231
C 1.557387 -3.527058 1.204131
C -3.266018 -0.504274 -1.170036
C -3.228395 0.535714 1.060667
C -3.888662 -0.172282 0.045796
H 3.445161 -0.419136 -0.429726
H 0.062467 2.896919 0.460295
H 1.379081 -0.510803 -1.750270
H 0.230196 1.422510 -1.671882
H 3.594270 1.185898 1.554099
H 2.618476 -0.262297 1.866889
H 2.876289 1.475076 -2.102328
H 4.038105 1.951910 -0.845383
H 0.648470 1.015435 2.147051
H 1.709011 2.433805 2.238301
H 2.538428 3.501550 0.121270
H 1.621582 3.359007 -1.395889
H -0.103955 -1.847793 -0.302392
H 0.614649 -1.145065 1.165970
H -1.427180 -0.353318 -2.302424
H -1.373632 1.483998 1.632527
H 2.545822 -2.359653 -1.831255
H 1.271277 -3.604911 -1.580326
H 2.955500 -3.886671 -1.007741
H 2.384007 -4.256476 1.281190
H 0.618411 -4.093419 0.974409
H 1.431045 -3.047184 2.191191
H -3.820976 -1.045854 -1.941792
H -3.755081 0.783551 1.987096


