%chk=000259049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259049

0 1
O 0.590707 -1.109235 0.795150
O 0.307595 -1.894563 -1.331199
N -1.227098 -0.387371 -0.409025
C -1.742075 0.175652 0.882344
C -2.839322 -0.742708 1.467685
C -3.940276 -1.067348 0.450429
C -2.256843 1.612257 0.657355
C -3.351820 -1.647782 -0.841833
C -2.271979 -0.722040 -1.422223
C -1.120980 2.577965 0.298683
C -0.099727 -1.220228 -0.404475
C -1.636477 4.013468 0.127978
C -0.507891 4.976676 -0.233477
C 1.922299 -1.711666 0.836065
C 2.918541 -0.772639 0.163522
C 4.359645 -1.230493 0.409819
C 5.365788 -0.296561 -0.277885
C 6.805639 -0.743017 -0.035557
H -0.880830 0.214521 1.607262
H -2.369291 -1.683190 1.818755
H -3.278940 -0.273713 2.366920
H -4.657108 -1.785473 0.892302
H -4.524606 -0.155023 0.222408
H -2.767167 1.955265 1.578362
H -3.029000 1.627126 -0.135673
H -2.920096 -2.649213 -0.644707
H -4.149838 -1.805279 -1.590977
H -1.784951 -1.191405 -2.308826
H -2.715792 0.240020 -1.762710
H -0.335640 2.548924 1.078149
H -0.624695 2.240027 -0.633620
H -2.416904 4.042620 -0.657359
H -2.131145 4.351114 1.059471
H -0.018220 4.689690 -1.171376
H 0.265048 5.002743 0.543032
H -0.883022 5.998389 -0.358302
H 1.882023 -2.705543 0.356046
H 2.072651 -1.805164 1.926126
H 2.767280 0.260154 0.534840
H 2.706053 -0.731118 -0.926101
H 4.496786 -2.264649 0.036821
H 4.567683 -1.268551 1.496530
H 5.162776 -0.262750 -1.366784
H 5.228478 0.740132 0.087131
H 7.516123 -0.072053 -0.531592
H 6.985781 -1.752887 -0.421796
H 7.053035 -0.751181 1.031912


%chk=000259049-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259049

0 1
O 0.518782 -1.030599 0.932360
O 0.276290 -1.929487 -1.228766
N -1.493140 -0.790500 -0.179141
C -2.039266 -0.052956 0.997280
C -3.368878 -0.723377 1.442580
C -4.371115 -0.902431 0.276422
C -2.200726 1.464577 0.702945
C -3.710237 -1.684728 -0.882133
C -2.400638 -0.999188 -1.330984
C -0.873243 2.180473 0.372043
C -0.210805 -1.294500 -0.249712
C -1.055038 3.693481 0.115628
C 0.272753 4.409310 -0.213770
C 1.932596 -1.492597 0.915951
C 2.853287 -0.456249 0.257539
C 4.339449 -0.876301 0.336577
C 5.287359 0.154051 -0.319442
C 6.772292 -0.260476 -0.239479
H -1.298485 -0.162801 1.805745
H -3.133793 -1.719809 1.866752
H -3.821126 -0.120471 2.253618
H -5.273214 -1.433950 0.633722
H -4.710620 0.086979 -0.091042
H -2.653598 1.930023 1.602570
H -2.921012 1.625625 -0.124105
H -3.482091 -2.717312 -0.552670
H -4.395797 -1.756932 -1.748211
H -1.857274 -1.607092 -2.071748
H -2.633824 -0.020145 -1.798823
H -0.156567 2.028854 1.205090
H -0.412114 1.710013 -0.519942
H -1.771402 3.839478 -0.719081
H -1.518458 4.163700 1.007412
H 0.741159 3.977123 -1.118175
H 0.994975 4.306105 0.618164
H 0.118487 5.488952 -0.395478
H 1.986245 -2.459577 0.383867
H 2.174212 -1.631642 1.983832
H 2.713051 0.523413 0.756005
H 2.554847 -0.336667 -0.801129
H 4.474127 -1.860175 -0.159077
H 4.633651 -1.016585 1.398210
H 4.995200 0.290192 -1.380281
H 5.149062 1.139454 0.170556
H 7.428307 0.489841 -0.717972
H 6.941151 -1.229306 -0.746492
H 7.097379 -0.371890 0.812386


