%chk=000245519.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245519

0 1
O 3.784178 1.293062 0.256554
O -3.808791 1.247894 0.316590
N 0.001238 -0.671157 0.495890
N 4.615148 -0.266330 -1.149728
N -4.606787 -0.259734 -1.163272
C 1.240062 0.170072 0.508822
C -1.239189 0.167772 0.509689
C 2.328887 -0.573425 -0.287505
C -2.323442 -0.573250 -0.295195
C 0.002356 -1.647580 1.624832
C 3.594827 0.249224 -0.344040
C -3.599985 0.234180 -0.327630
H 1.045448 1.154344 0.025405
H 1.612206 0.403913 1.530664
H -1.615771 0.393997 1.531817
H -1.045168 1.155536 0.033648
H 2.532320 -1.561515 0.173963
H 1.946480 -0.799349 -1.305355
H -1.943567 -0.776631 -1.318446
H -2.513445 -1.572058 0.149187
H 0.887955 -2.296967 1.541229
H -0.885270 -2.294761 1.545292
H 0.005028 -1.191316 2.626938
H 5.483729 0.238461 -1.237380
H 4.527314 -1.102469 -1.693603
H -5.481681 0.236445 -1.236053
H -4.502777 -1.069657 -1.742814


%chk=000245519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245519

0 1
O 3.310873 1.385050 -1.331752
O -4.106224 0.523904 1.200120
N -0.018923 -0.730516 0.281049
N 4.838173 -0.152522 -0.513800
N -4.612096 0.238555 -1.045062
C 1.194340 0.120060 0.208898
C -1.267354 0.069882 0.386742
C 2.431552 -0.663669 -0.276571
C -2.485047 -0.691894 -0.192252
C 0.072586 -1.760677 1.338883
C 3.542850 0.286095 -0.746287
C -3.788527 0.072153 0.059237
H 1.018251 0.928192 -0.522540
H 1.425772 0.609057 1.189985
H -1.501803 0.366087 1.435751
H -1.126349 1.002838 -0.189289
H 2.814975 -1.354388 0.497561
H 2.117766 -1.278181 -1.143912
H -2.316048 -0.891214 -1.265726
H -2.579576 -1.672316 0.312582
H 0.908723 -2.450996 1.132376
H -0.851095 -2.363918 1.364293
H 0.221994 -1.321516 2.357635
H 5.613355 0.421564 -0.845658
H 5.036285 -1.027395 -0.032124
H -5.496644 0.731949 -0.922885
H -4.356504 -0.107484 -1.967755


