%chk=000244838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244838

0 1
O 1.048947 0.239726 -1.394642
O 1.641102 0.474187 2.175411
O 3.230201 -0.979497 -1.550439
O 0.128858 -1.490504 2.226299
O 4.192550 0.097953 1.838399
O 5.172040 0.924554 -1.587332
N -1.724759 -0.062467 -0.720057
N -2.486066 -0.666318 1.363587
C 1.862104 0.468810 -0.234175
C 0.887061 0.407756 0.966977
C 3.002088 -0.583208 -0.193667
C 0.009451 -0.882384 0.942484
C 4.325623 -0.099665 0.445055
C -1.404490 -0.551951 0.568231
C 4.876204 1.187561 -0.205283
C -3.113548 0.144871 -0.726684
C -3.577641 -0.241792 0.582411
C -3.999391 0.615345 -1.714831
C -4.950078 -0.155206 0.896201
C -5.337357 0.688479 -1.372516
C -5.806853 0.308096 -0.084455
H 2.263879 1.503652 -0.346743
H 0.261753 1.333074 0.992426
H 2.666650 -1.528043 0.298452
H 0.430072 -1.659350 0.251755
H 5.081574 -0.922766 0.376234
H 4.128420 2.002871 -0.253332
H 5.771696 1.552165 0.326513
H -1.061801 0.147373 -1.457075
H 1.515438 -0.404281 -2.017222
H 1.646780 -0.426792 2.637137
H 3.805988 -0.293379 -2.020865
H -0.614149 -1.207109 2.829488
H 3.405676 0.691651 2.053887
H -3.638934 0.904051 -2.697070
H -5.298348 -0.450396 1.884534
H 6.028211 0.448465 -1.667962
H -6.064063 1.046111 -2.102221
H -6.873887 0.388859 0.120588


%chk=000244838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244838

0 1
O 0.941654 0.472221 -1.242856
O 1.810721 0.068399 2.349553
O 3.058004 -0.800824 -1.636645
O -0.176030 -1.501915 2.423004
O 4.221810 0.752618 1.618766
O 5.317624 0.524407 -1.928266
N -1.663196 0.076046 -0.610325
N -2.486980 -0.881890 1.291027
C 1.790574 0.580733 -0.044772
C 0.918093 0.311421 1.208071
C 2.975285 -0.447105 -0.201402
C -0.014782 -0.942704 1.073338
C 4.339628 0.089268 0.331748
C -1.389181 -0.592936 0.567194
C 4.981877 1.134406 -0.607582
C -3.056062 0.236536 -0.675710
C -3.564430 -0.373148 0.527986
C -3.905041 0.832388 -1.630785
C -4.953565 -0.390486 0.782862
C -5.289064 0.806569 -1.356439
C -5.804999 0.204992 -0.170597
H 2.189998 1.611578 0.017939
H 0.295292 1.201367 1.427013
H 2.724450 -1.377882 0.337130
H 0.463714 -1.705739 0.431059
H 5.028622 -0.783006 0.410499
H 4.284706 1.955598 -0.836809
H 5.880239 1.555121 -0.123632
H -0.888585 0.405132 -1.214658
H 1.540306 -0.026010 -1.896534
H 1.295175 -0.547063 2.956496
H 3.908261 -0.404863 -2.024193
H -1.170916 -1.509399 2.596154
H 3.368638 0.459861 2.088245
H -3.516782 1.294432 -2.543943
H -5.346270 -0.853801 1.692954
H 6.194252 0.071083 -1.884344
H -5.985008 1.258295 -2.071842
H -6.887032 0.206801 -0.000209


