%chk=000253035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253035

0 1
O 3.731384 2.535171 1.833063
O 3.978808 2.330868 -0.382183
N -0.453141 -0.131080 -1.765056
N -1.795902 -0.281493 -1.627849
C 1.607654 0.630796 -0.507430
C 0.136440 0.377488 -0.598695
C 1.937825 1.504036 0.719810
C 2.396649 -0.665981 -0.455402
C -0.904761 0.555385 0.314152
C -2.103350 0.137487 -0.358605
C 3.659523 -0.718103 -1.064432
C 1.893638 -1.797077 0.201515
C -3.468090 0.139043 0.170905
C 3.292358 2.132205 0.592653
C 4.405701 -1.898296 -1.025977
C 2.643835 -2.976068 0.236086
C 3.898579 -3.029911 -0.378541
C -3.685334 0.022132 1.554825
C -4.567102 0.258551 -0.697658
C -4.987308 0.032359 2.060342
C -5.865731 0.267417 -0.183674
C -6.078530 0.156447 1.194150
H 1.920830 1.207249 -1.427836
H 1.179424 2.312434 0.842047
H 1.875558 0.905999 1.658055
H -0.848121 0.932671 1.312435
H 0.008537 -0.414918 -2.617186
H 4.067980 0.169142 -1.554937
H 0.915875 -1.762443 0.683296
H 5.385631 -1.934904 -1.500135
H 2.247851 -3.854489 0.743950
H 4.480393 -3.949490 -0.351562
H -2.840657 -0.083895 2.232844
H -4.400804 0.339308 -1.773058
H -5.152317 -0.058603 3.132542
H -6.714276 0.360185 -0.859714
H -7.091485 0.164656 1.591597
H 4.625938 2.970422 1.802961


%chk=000253035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253035

0 1
O 3.879690 1.940607 2.354686
O 3.919204 2.371247 0.074879
N -0.413298 -0.528196 -1.326569
N -1.788056 -0.670827 -1.259556
C 1.595349 0.605095 -0.275648
C 0.113157 0.289699 -0.336733
C 1.949162 1.263505 1.086242
C 2.470338 -0.631092 -0.543505
C -0.992875 0.711751 0.418782
C -2.150087 0.102049 -0.179400
C 3.567041 -0.551319 -1.437538
C 2.217532 -1.858654 0.124062
C -3.566707 0.212555 0.219051
C 3.326177 1.898990 1.070025
C 4.393837 -1.675827 -1.664325
C 3.043604 -2.981345 -0.099449
C 4.134962 -2.894060 -0.996127
C -3.957128 1.007676 1.330209
C -4.572979 -0.480975 -0.509475
C -5.314479 1.107406 1.703753
C -5.927804 -0.380369 -0.135041
C -6.307403 0.414127 0.973733
H 1.829745 1.355997 -1.057372
H 1.228584 2.076254 1.305655
H 1.887043 0.540552 1.916215
H -0.974750 1.366935 1.286314
H 0.103741 -1.048450 -2.033360
H 3.780542 0.398345 -1.941513
H 1.365196 -1.937374 0.810628
H 5.238140 -1.598813 -2.358345
H 2.836040 -3.923067 0.420932
H 4.774246 -3.766395 -1.171849
H -3.200667 1.551948 1.906831
H -4.271209 -1.092539 -1.365589
H -5.597457 1.725643 2.563288
H -6.690533 -0.920802 -0.707153
H -7.361168 0.491898 1.263788
H 4.766773 2.392527 2.316771


