%chk=000190519.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190519

0 1
S -0.219606 -2.673037 -0.135992
F -2.249675 -3.295656 1.312741
F -2.499127 -3.664122 -0.746402
N -1.615725 2.225211 -0.244463
N 2.927599 1.184116 -0.803703
N 0.671882 1.727288 -0.438216
N -0.967511 -0.084686 -0.172623
N 1.391216 -0.625777 -0.441814
C -3.048613 1.903887 0.044003
C 4.102361 0.279842 -0.754879
C 4.720207 0.235552 0.652680
C -3.913048 2.989702 -0.601287
C -3.272706 1.820663 1.556209
C -0.630052 1.271413 -0.276655
C 1.650441 0.748988 -0.542597
C 5.989957 -0.608198 0.660860
C 0.086047 -0.938152 -0.265065
C -2.037181 -2.729889 0.108272
H -3.282883 0.907240 -0.423693
H 4.838880 0.648942 -1.503262
H 3.802344 -0.748661 -1.074398
H -1.333784 3.206341 -0.249624
H 3.981709 -0.185961 1.366845
H 4.941426 1.258480 1.013212
H -4.978457 2.755546 -0.480773
H -3.752389 3.978602 -0.156867
H -3.721783 3.074499 -1.679056
H -2.659375 1.024491 2.002098
H -4.318787 1.591603 1.788787
H -3.019395 2.753727 2.070729
H 3.104603 2.188678 -0.773667
H 5.790929 -1.641819 0.350154
H 6.757493 -0.203344 -0.008370
H 6.424925 -0.653404 1.666968
H -2.598523 -1.772405 0.005848


%chk=000190519-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190519

0 1
S -0.125853 -2.692189 -0.004975
F -2.313445 -3.242798 1.522845
F -2.618846 -3.515970 -0.716051
N -1.625854 2.210750 -0.239484
N 2.922727 1.254777 -0.710909
N 0.657684 1.776912 -0.466890
N -0.931086 -0.044596 -0.121944
N 1.431140 -0.541113 -0.366492
C -3.054737 1.889730 -0.017621
C 4.102830 0.374368 -0.732834
C 4.753527 0.188126 0.659146
C -3.916091 3.008304 -0.637078
C -3.357586 1.686468 1.486122
C -0.612351 1.296575 -0.273868
C 1.643011 0.822086 -0.507926
C 5.996014 -0.724430 0.586269
C 0.136351 -0.874222 -0.185823
C -1.982076 -2.684470 0.252064
H -3.252969 0.938848 -0.545679
H 4.838048 0.801962 -1.441296
H 3.782409 -0.607161 -1.121090
H -1.339823 3.187442 -0.336984
H 4.000203 -0.249195 1.340764
H 5.033074 1.177103 1.073785
H -4.987232 2.774266 -0.512247
H -3.726764 3.978427 -0.137686
H -3.710524 3.121851 -1.716321
H -2.715599 0.893397 1.905964
H -4.412991 1.390473 1.628958
H -3.180274 2.619670 2.051961
H 3.036397 2.267980 -0.773637
H 5.729623 -1.727289 0.204032
H 6.768487 -0.300766 -0.083490
H 6.451133 -0.855274 1.584118
H -2.355158 -1.650341 0.180295


