%chk=000234077.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234077

0 1
O -2.151279 3.284276 1.639563
N -1.670315 1.848922 -0.102557
N 3.720832 0.624887 0.987356
N 2.057503 -0.701973 -2.681724
C -4.461850 -1.469067 -1.403406
C -3.547653 -2.355525 -0.547387
C -4.363108 0.037469 -1.122866
C -2.054880 -2.054552 -0.730196
C -4.561659 0.389702 0.356585
C -1.184262 -3.069166 0.026049
C -4.904044 1.864273 0.601341
C 0.292470 -2.655096 0.017224
C -3.899108 2.870931 0.030543
C 1.171416 -3.671047 0.759968
C -2.516087 2.706644 0.635539
C 2.623579 -3.203988 0.833225
C -0.295603 1.558974 0.172073
C 1.786642 0.519525 -0.545324
C 0.419503 0.842918 -0.774555
C 2.401162 0.924130 0.670613
C 0.331181 1.990274 1.387787
C 1.639807 1.677094 1.628838
C 2.609496 -0.217023 -1.483970
C 3.929130 -0.497212 -1.158646
C 4.447615 -0.067105 0.101324
C 5.861955 -0.387515 0.464115
H -5.510511 -1.797823 -1.253986
H -4.245491 -1.646549 -2.475838
H -3.817492 -2.254623 0.522019
H -3.744890 -3.416629 -0.801897
H -5.120018 0.562874 -1.738908
H -3.377854 0.414485 -1.469385
H -1.830922 -1.033228 -0.366100
H -1.792232 -2.063134 -1.804211
H -3.655785 0.110151 0.932119
H -5.376205 -0.233341 0.780333
H -1.536677 -3.163293 1.071669
H -1.299369 -4.073876 -0.422605
H -5.000406 2.031137 1.696021
H -5.903592 2.089150 0.175820
H 0.653350 -2.538417 -1.023260
H 0.407007 -1.654762 0.482082
H -3.879125 2.818873 -1.074597
H -4.244038 3.903447 0.267865
H 0.780680 -3.831261 1.783809
H 1.117864 -4.655266 0.256395
H 3.256435 -3.946153 1.329463
H 2.715980 -2.264193 1.393436
H 3.040042 -3.020806 -0.164534
H -2.091947 1.315665 -0.878407
H -0.053394 0.508477 -1.694389
H -0.253552 2.571376 2.113472
H 2.141304 1.985962 2.549836
H 4.576455 -1.046521 -1.832431
H 6.026022 -1.473410 0.498372
H 6.566751 0.039248 -0.262176
H 6.131259 0.014507 1.455431
H 1.231631 -0.244761 -3.036787
H 2.700471 -0.985754 -3.405741


%chk=000234077-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234077

0 1
O -2.387169 3.006732 1.540277
N -1.371015 1.997803 -0.325700
N 3.903274 0.896187 1.453590
N 2.804713 -0.233712 -2.521290
C -5.004543 -1.745688 -0.671243
C -3.844259 -2.407274 0.115173
C -4.876604 -0.215515 -0.883346
C -2.461709 -2.302072 -0.570964
C -4.876144 0.600150 0.431632
C -1.369660 -3.125788 0.149363
C -4.945998 2.133464 0.232164
C 0.016746 -3.045900 -0.528882
C -3.718448 2.740480 -0.498002
C 1.090882 -3.900450 0.183110
C -2.442183 2.600209 0.341458
C 2.471158 -3.839511 -0.506381
C -0.050684 1.729209 0.139884
C 2.179398 0.797228 -0.360746
C 0.841448 1.100793 -0.747899
C 2.623344 1.144833 0.972106
C 0.384009 2.073891 1.463249
C 1.691033 1.782260 1.850720
C 3.143156 0.144158 -1.228647
C 4.432045 -0.097414 -0.717342
C 4.775891 0.289759 0.615326
C 6.170270 0.020033 1.145378
H -5.958266 -1.948900 -0.141570
H -5.086179 -2.238832 -1.662335
H -3.780409 -1.974240 1.133644
H -4.085580 -3.481281 0.255313
H -5.723383 0.126776 -1.514489
H -3.955326 -0.004764 -1.463775
H -2.139273 -1.240743 -0.613347
H -2.549094 -2.649128 -1.622893
H -3.978924 0.354050 1.033525
H -5.748726 0.287806 1.041132
H -1.283139 -2.778280 1.199762
H -1.691004 -4.187747 0.198927
H -5.024824 2.627910 1.218502
H -5.859013 2.393087 -0.339910
H -0.071743 -3.377411 -1.585772
H 0.353736 -1.988440 -0.555387
H -3.601051 2.292261 -1.503426
H -3.893490 3.824049 -0.643799
H 1.187710 -3.557835 1.233153
H 0.744316 -4.953536 0.229409
H 3.213468 -4.465959 0.022120
H 2.856862 -2.802990 -0.526826
H 2.407292 -4.199731 -1.551497
H -1.560786 1.708160 -1.287913
H 0.480458 0.851255 -1.755893
H -0.320128 2.558498 2.141375
H 2.049431 2.034963 2.853229
H 5.188348 -0.588619 -1.341040
H 6.399374 -1.062556 1.139109
H 6.938966 0.521701 0.527509
H 6.246579 0.392184 2.178478
H 1.871912 -0.097637 -2.895874
H 3.487128 -0.705634 -3.108027


