%chk=000286780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286780

0 1
O -1.290803 -2.039883 0.433450
O -5.343705 -0.342783 0.226864
O -2.811222 3.251992 -0.183764
O -0.533161 -2.352009 -1.698081
N -1.198337 1.648078 -0.040193
N 1.528141 -0.734663 0.154840
C -0.761799 0.288766 0.086750
C -0.039128 2.594472 -0.170604
C 1.155879 1.686667 -0.094975
C 0.713774 0.300953 0.058775
C -1.664260 -0.726773 0.204406
C -2.551034 2.068407 -0.066258
C -3.077162 -0.429240 0.198026
C -3.501985 0.961923 0.064619
C 2.487629 1.960286 -0.147745
C 3.411475 0.861885 -0.048312
C 2.901625 -0.461240 0.099928
C -4.220132 -1.181733 0.294130
C -4.876042 0.956439 0.087034
C 4.823253 1.054065 -0.094774
C 3.806358 -1.564548 0.197641
C 5.674622 -0.021663 0.001680
C 5.161188 -1.341262 0.148658
C -0.584864 -2.747512 -0.568708
C -0.050233 -3.972999 0.074672
H -0.068794 3.346344 0.649770
H -0.104981 3.146250 -1.135706
H 2.872105 2.972735 -0.262695
H -4.462618 -2.214808 0.404273
H -5.647113 1.697436 0.023774
H 5.212142 2.065706 -0.208655
H 3.393533 -2.567541 0.307695
H 6.754692 0.119065 -0.033874
H 5.863633 -2.171962 0.220659
H -0.635105 -4.277381 0.957886
H 0.979551 -3.780919 0.430127
H -0.014421 -4.814146 -0.633016


%chk=000286780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286780

0 1
O -1.272288 -2.073208 0.459530
O -5.349946 -0.302435 0.350411
O -2.823997 3.316006 -0.239102
O -0.467424 -2.314584 -1.740647
N -1.206856 1.636496 -0.082598
N 1.520146 -0.740388 0.193434
C -0.766659 0.294572 0.082051
C -0.076102 2.589400 -0.250013
C 1.129501 1.682902 -0.143370
C 0.699647 0.316589 0.053547
C -1.674022 -0.735017 0.246790
C -2.542595 2.086129 -0.087116
C -3.074230 -0.407860 0.265229
C -3.495332 0.985107 0.102284
C 2.485494 1.961626 -0.202230
C 3.413056 0.871870 -0.060080
C 2.883591 -0.468835 0.138880
C -4.234425 -1.159835 0.413040
C -4.879426 1.001039 0.159424
C 4.830630 1.058707 -0.106789
C 3.796484 -1.561325 0.282352
C 5.697648 -0.028096 0.036826
C 5.176074 -1.346247 0.232746
C -0.567208 -2.762735 -0.590309
C -0.023158 -4.052570 -0.036487
H -0.121003 3.367561 0.534325
H -0.159455 3.104275 -1.225320
H 2.862638 2.979858 -0.352102
H -4.447559 -2.212310 0.562855
H -5.626078 1.784728 0.087621
H 5.228837 2.069415 -0.257668
H 3.374709 -2.560677 0.427535
H 6.781568 0.124419 -0.000792
H 5.866955 -2.189112 0.342313
H -0.789012 -4.580525 0.555012
H 0.813103 -3.805607 0.641566
H 0.339396 -4.690931 -0.854852


