%chk=000269058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269058

0 1
O 1.361517 2.093754 0.181063
O -0.932987 -2.188362 -0.274883
N -0.226423 0.002280 -0.138205
N 5.396780 -0.617159 -0.402100
C 1.188689 -0.212414 -0.188598
C 2.049477 0.913194 -0.019376
C 1.775994 -1.466091 -0.401589
C 3.434403 0.793201 -0.053135
C 3.996032 -0.485984 -0.275160
C -2.602204 -0.471526 -0.108347
C 3.163218 -1.608620 -0.442074
C -1.199001 -1.002363 -0.186358
C -3.423166 -0.892473 0.945591
C -3.096144 0.393059 -1.093056
C -4.740782 -0.431717 1.020732
C -4.416086 0.846358 -1.014381
C -5.236178 0.437266 0.042812
C 2.128997 3.313431 0.320997
H 1.135434 -2.349631 -0.534593
H -0.512587 0.979547 -0.022900
H 4.077727 1.655780 0.067662
H 3.590439 -2.591942 -0.617813
H -3.035211 -1.583467 1.695706
H -2.459937 0.702077 -1.922468
H -5.382544 -0.755179 1.838952
H -4.806435 1.515654 -1.779389
H -6.264216 0.792714 0.102031
H 5.779524 -1.541929 -0.270984
H 5.963527 0.100422 0.022792
H 2.761143 3.260665 1.212194
H 1.336752 4.063419 0.442161
H 2.713250 3.499337 -0.585284


%chk=000269058-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269058

0 1
O 1.324001 2.092806 -0.121767
O -1.000246 -2.254249 0.121641
N -0.190981 -0.058754 -0.023839
N 5.452163 -0.617747 -0.263953
C 1.208657 -0.286608 -0.077278
C 2.039610 0.873890 -0.133074
C 1.833672 -1.556236 -0.082748
C 3.440662 0.777209 -0.195189
C 4.059093 -0.507661 -0.202583
C -2.611672 -0.437308 0.033474
C 3.236608 -1.665496 -0.145827
C -1.209678 -0.998668 0.042899
C -3.651892 -1.295067 0.475741
C -2.942387 0.868483 -0.419196
C -4.990487 -0.852986 0.488785
C -4.283886 1.309786 -0.409107
C -5.311660 0.453522 0.049864
C 2.088797 3.337550 -0.163259
H 1.201116 -2.444441 -0.033972
H -0.439730 0.933839 -0.004257
H 4.062890 1.676966 -0.238882
H 3.697836 -2.659843 -0.148873
H -3.378883 -2.306138 0.794991
H -2.173031 1.541744 -0.817380
H -5.783043 -1.524324 0.837485
H -4.528072 2.315615 -0.768686
H -6.351927 0.797731 0.056114
H 5.896150 -1.530743 -0.268424
H 6.044340 0.205776 -0.302381
H 2.758158 3.422851 0.714421
H 1.339644 4.142745 -0.138171
H 2.683182 3.409057 -1.094570


