%chk=000246226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246226

0 1
O 0.995063 0.000005 0.522877
O -0.684896 2.325496 0.390696
O -0.685105 -2.325409 0.391773
N -0.382051 0.000044 0.451330
C -2.591599 0.786982 0.685058
C -2.591672 -0.786588 0.685412
C -3.496650 1.139370 -0.541721
C -3.496728 -1.139450 -0.541229
C -3.115750 -0.000269 -1.544180
C -4.901925 0.673274 -0.142020
C -4.901977 -0.673091 -0.141753
C -1.140519 1.220350 0.499354
C -1.140627 -1.220174 0.499943
C 1.617358 -0.000377 -0.822825
C 3.078379 -0.000216 -0.479982
C 3.760577 1.214697 -0.315279
C 3.760810 -1.214973 -0.315086
C 5.123845 1.211470 -0.008255
C 5.124077 -1.211436 -0.008066
C 5.806909 0.000095 0.142286
H -2.992411 1.217148 1.624407
H -2.992541 -1.216295 1.624948
H -3.401865 2.169521 -0.897529
H -3.402007 -2.169761 -0.896590
H -2.067694 -0.000372 -1.860731
H -3.728386 -0.000445 -2.455038
H -5.688461 1.362857 0.089594
H -5.688562 -1.362523 0.090144
H 1.294039 0.904083 -1.364714
H 1.294092 -0.905189 -1.364160
H 3.225677 2.158924 -0.416821
H 3.226094 -2.159320 -0.416479
H 5.653066 2.154478 0.118361
H 5.653480 -2.154322 0.118697
H 6.868962 0.000214 0.381180


%chk=000246226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246226

0 1
O 0.974110 -0.000304 0.802016
O -0.726201 2.356685 0.636289
O -0.726933 -2.356899 0.637500
N -0.447879 -0.000125 0.725535
C -2.679951 0.784572 0.726049
C -2.680195 -0.784131 0.726482
C -3.463714 1.142726 -0.606590
C -3.464083 -1.142775 -0.605953
C -2.969696 -0.000367 -1.549455
C -4.907133 0.683054 -0.353417
C -4.907353 -0.682498 -0.353033
C -1.207243 1.203763 0.696294
C -1.207613 -1.203797 0.696915
C 1.567241 -0.000611 -0.604784
C 3.060734 -0.000310 -0.432169
C 3.770389 1.223694 -0.338725
C 3.770936 -1.224002 -0.338841
C 5.171032 1.224856 -0.160727
C 5.171583 -1.224556 -0.160850
C 5.873989 0.000302 -0.073453
H -3.162187 1.236758 1.607922
H -3.162554 -1.235684 1.608612
H -3.318433 2.181084 -0.935455
H -3.319135 -2.181362 -0.934242
H -1.878290 -0.000593 -1.724314
H -3.495992 -0.000550 -2.516846
H -5.741467 1.351324 -0.126579
H -5.741903 -1.350372 -0.125821
H 1.203381 0.909465 -1.115014
H 1.203665 -0.911075 -1.114521
H 3.221676 2.171207 -0.396596
H 3.222652 -2.171758 -0.396806
H 5.712667 2.174315 -0.089332
H 5.713643 -2.173780 -0.089554
H 6.961260 0.000540 0.063065


