%chk=000291054.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291054

0 1
O -2.877297 2.832899 0.046264
N -1.127317 -0.806350 -0.368967
N -0.984354 1.586111 -0.313748
C 1.070200 0.299782 -0.693034
C 1.822316 -0.002643 0.612087
C -0.410289 0.420765 -0.446305
C 3.298711 -0.131637 0.347262
C -2.522849 -0.785139 -0.134577
C -3.168565 0.461983 0.013943
C -2.395289 1.731190 -0.072427
C -3.254244 -1.991726 -0.052338
C 3.883420 -1.397476 0.196521
C 4.096132 1.018790 0.245531
C -4.556139 0.488451 0.245269
C -4.623477 -1.931575 0.177111
C -5.278925 -0.695910 0.326591
C 5.254729 -1.509468 -0.051529
C 5.465608 0.900792 -0.003347
C 6.047777 -0.362566 -0.152381
H 1.293352 -0.465430 -1.464005
H 1.445631 1.261860 -1.123077
H 1.426182 -0.920729 1.089180
H 1.633522 0.811838 1.347344
H -0.651273 -1.698793 -0.470267
H -2.756782 -2.950406 -0.167117
H 3.274981 -2.295093 0.275345
H 3.647992 2.004877 0.361884
H -5.047785 1.460922 0.358758
H -5.201297 -2.855557 0.242717
H -6.352192 -0.672339 0.505580
H 5.705821 -2.493975 -0.165601
H 6.081428 1.796022 -0.080545
H 7.114974 -0.451770 -0.345023


%chk=000291054-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291054

0 1
O -2.564637 2.574653 1.075058
N -1.298654 -0.976372 -0.504848
N -0.806712 1.224327 0.309730
C 1.046015 -0.175915 -0.494515
C 1.944634 0.119354 0.744482
C -0.423510 0.063830 -0.203360
C 3.422026 0.008027 0.401142
C -2.683597 -0.853378 -0.288491
C -3.153570 0.375503 0.259821
C -2.186823 1.472780 0.582996
C -3.583402 -1.904207 -0.600354
C 4.138894 -1.193980 0.632382
C 4.105929 1.099501 -0.195596
C -4.542981 0.533949 0.491460
C -4.957488 -1.722046 -0.361265
C -5.442266 -0.502912 0.185338
C 5.502415 -1.306326 0.275810
C 5.468353 0.992650 -0.553386
C 6.171492 -0.212812 -0.320623
H 1.218421 -1.211177 -0.849241
H 1.349663 0.502341 -1.314069
H 1.681564 -0.585752 1.555462
H 1.686981 1.133985 1.096173
H -0.926388 -1.843571 -0.896833
H -3.211564 -2.845255 -1.022970
H 3.628306 -2.043328 1.104406
H 3.568039 2.040362 -0.368178
H -4.878093 1.486956 0.913847
H -5.658381 -2.529243 -0.600131
H -6.514389 -0.375367 0.366220
H 6.042569 -2.240587 0.467622
H 5.982637 1.847848 -1.006461
H 7.229221 -0.296136 -0.594531


