%chk=000273565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273565

0 1
O -1.069176 -3.498289 -1.134970
O 0.862796 -0.549122 2.744923
O -0.144920 2.883566 -0.864723
N -0.395932 -0.547162 0.864083
N -2.314384 3.263814 -1.370554
C -0.731774 -0.026586 -0.491636
C -2.873894 -0.598700 0.835840
C -1.526806 -1.145085 -1.239200
C -2.819801 -1.463381 -0.449488
C -1.604451 -0.909093 1.675133
C -1.692452 1.149695 -0.304848
C -2.794177 0.852019 0.405805
C -0.670936 -2.398866 -1.444369
C 0.819755 -0.341034 1.543891
C -1.296204 2.471356 -0.843690
C 0.664067 -2.191022 -2.093696
C 2.022189 0.000833 0.721307
C 2.202334 1.284615 0.195792
C 3.006219 -0.984028 0.548756
C 3.367167 1.578556 -0.520775
C 4.164392 -0.684158 -0.171769
C 4.344942 0.597000 -0.706554
H 0.188993 0.268651 -1.047490
H -3.787035 -0.819342 1.424641
H -1.798736 -0.759547 -2.251209
H -2.849032 -2.542153 -0.178872
H -3.709755 -1.282199 -1.074321
H -1.602976 -0.352649 2.638212
H -1.548042 -1.992706 1.920555
H -3.580388 1.536616 0.689858
H 0.638446 -1.485102 -2.930519
H 1.400577 -1.808840 -1.366319
H 1.070658 -3.142103 -2.471527
H -2.093405 4.172560 -1.750197
H -3.273581 2.977002 -1.417246
H 1.436108 2.058610 0.330707
H 2.871079 -1.973100 0.988733
H 3.506715 2.578142 -0.931939
H 4.931499 -1.444663 -0.307878
H 5.251524 0.829994 -1.263545


%chk=000273565-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273565

0 1
O -0.788284 -3.455826 -0.916194
O 0.909608 -1.096346 2.582195
O -0.285994 2.813016 -1.372108
N -0.450160 -0.390991 0.862618
N -2.512337 3.426549 -1.168219
C -0.804719 0.049470 -0.516832
C -2.904830 -0.559147 0.838079
C -1.549026 -1.145069 -1.234657
C -2.808167 -1.512249 -0.398420
C -1.622160 -0.774028 1.695662
C -1.802700 1.200893 -0.401854
C -2.905652 0.874420 0.335562
C -0.587519 -2.335496 -1.453949
C 0.812935 -0.566318 1.425465
C -1.474046 2.524859 -1.010789
C 0.624134 -2.086801 -2.341051
C 2.056451 -0.157083 0.674106
C 2.198720 1.075741 -0.016042
C 3.174355 -1.028335 0.776631
C 3.435544 1.414147 -0.611616
C 4.401196 -0.694124 0.166704
C 4.535360 0.530227 -0.532055
H 0.093601 0.354023 -1.067184
H -3.795024 -0.793868 1.444292
H -1.830524 -0.774337 -2.240769
H -2.714883 -2.556762 -0.049479
H -3.724380 -1.435659 -1.008599
H -1.632753 -0.166709 2.619411
H -1.535328 -1.834284 1.996921
H -3.713665 1.570158 0.591903
H 0.407178 -1.370627 -3.152964
H 1.444493 -1.657165 -1.732600
H 0.982701 -3.040531 -2.759595
H -2.294272 4.349292 -1.542457
H -3.479452 3.190171 -0.957757
H 1.368972 1.786846 -0.088636
H 3.065947 -1.952609 1.353457
H 3.532825 2.371874 -1.134328
H 5.252748 -1.379109 0.244813
H 5.490706 0.795884 -0.998765


