%chk=000219096.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219096

0 1
O 4.338015 -2.266124 -0.944223
N -2.009195 0.349299 0.086600
C -0.058889 1.838605 0.567559
C 0.744834 1.150387 -0.593718
C -1.040344 0.763412 1.149211
C -0.273136 0.647512 -1.664184
C -1.337054 -0.294590 -1.084911
C -0.241962 -0.396431 1.790530
C 1.470307 -0.093204 -0.083471
C -4.285814 -0.484532 -0.324064
C -3.104383 -0.518658 0.631286
C 1.694270 2.142028 -1.321531
C -0.868065 3.047278 0.064072
C 0.855001 2.329148 1.705939
C 0.981931 -0.816925 1.025380
C -5.493394 -1.362483 -0.035715
C -4.593836 -1.678144 -1.215199
C 2.592993 -0.580880 -0.771165
C 2.926853 2.600080 -0.548591
C 1.644906 -1.980727 1.455458
C 3.226146 -1.743151 -0.319366
C 2.773944 -2.459407 0.797899
H -1.651159 1.251162 1.954007
H 0.264800 0.125789 -2.477233
H -0.772643 1.520129 -2.129074
H -2.115852 -0.490953 -1.855211
H -0.881353 -1.277324 -0.832171
H -0.908102 -1.271711 1.932211
H 0.063180 -0.094744 2.815048
H -4.460360 0.520332 -0.734433
H -2.778069 -1.563708 0.824742
H -3.433043 -0.101745 1.610702
H 1.104665 3.035634 -1.617430
H 2.026003 1.680741 -2.274596
H -1.370960 3.559542 0.890122
H -1.655619 2.738745 -0.637774
H -0.229662 3.777471 -0.443128
H 0.278162 2.613048 2.590680
H 1.429549 3.213768 1.395115
H 1.584461 1.570619 2.009998
H -6.492040 -0.970881 -0.211946
H -5.492025 -2.022019 0.827909
H -3.958800 -2.559465 -1.180794
H -4.956546 -1.510433 -2.226023
H 2.968639 -0.061586 -1.648249
H 2.661392 3.316789 0.243025
H 3.445274 1.765758 -0.060790
H 3.644419 3.094815 -1.211537
H 1.267429 -2.525780 2.321199
H 3.295634 -3.355661 1.120201
H 4.613697 -1.724127 -1.720866


%chk=000219096-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219096

0 1
O 4.476137 -2.278418 -0.926263
N -2.002195 0.304340 0.109580
C -0.054895 1.825061 0.593304
C 0.760820 1.130095 -0.583820
C -1.036153 0.741750 1.156241
C -0.275048 0.587932 -1.643476
C -1.354431 -0.336479 -1.055880
C -0.235680 -0.415819 1.825057
C 1.517820 -0.108521 -0.043049
C -4.358295 -0.421062 -0.324365
C -3.170882 -0.435316 0.633389
C 1.690661 2.106384 -1.382593
C -0.884687 3.044563 0.112800
C 0.851132 2.308893 1.763517
C 1.001630 -0.860544 1.052272
C -5.536008 -1.374232 -0.073420
C -4.620700 -1.591740 -1.288297
C 2.677041 -0.592627 -0.705487
C 2.935139 2.708725 -0.688033
C 1.665541 -2.048973 1.452316
C 3.320904 -1.777626 -0.289895
C 2.818969 -2.520283 0.800575
H -1.645616 1.229982 1.944403
H 0.281089 0.037346 -2.427317
H -0.762560 1.451924 -2.133227
H -2.127353 -0.527219 -1.821216
H -0.907904 -1.327607 -0.792145
H -0.907894 -1.282451 1.984981
H 0.074095 -0.089399 2.838723
H -4.605367 0.581042 -0.693831
H -2.933772 -1.504612 0.882601
H -3.470642 0.052594 1.582578
H 1.060940 2.930295 -1.769718
H 2.026619 1.565614 -2.291160
H -1.389097 3.506028 0.983884
H -1.670995 2.748932 -0.599847
H -0.247655 3.822777 -0.345331
H 0.235456 2.469737 2.670192
H 1.328454 3.272703 1.523002
H 1.648789 1.588430 2.012284
H -6.550776 -1.004315 -0.245040
H -5.451065 -2.080754 0.759376
H -3.929723 -2.440928 -1.255828
H -5.018419 -1.370875 -2.283359
H 3.084199 -0.041382 -1.561895
H 2.673191 3.523000 0.007348
H 3.493773 1.947393 -0.115723
H 3.621373 3.134752 -1.444359
H 1.260535 -2.620893 2.296810
H 3.328430 -3.437459 1.109439
H 4.749277 -1.684063 -1.668597


