%chk=000245793.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245793

0 1
O 2.005417 -1.808402 0.734120
O -0.231028 1.344631 -1.437116
O 2.731518 1.881534 1.215714
O 4.413147 0.968965 0.059521
N -1.546578 0.896379 0.372857
C 0.792866 0.144281 0.400162
C 2.128776 0.232873 -0.400897
C 0.603960 -1.410280 0.530695
C 2.523556 -1.283228 -0.541464
C 0.352411 -1.978741 -0.870284
C 1.524541 -1.901953 -1.523853
C -0.347289 0.840211 -0.331427
C 3.224101 1.009220 0.271344
C -2.763073 1.489438 -0.236649
C -3.862830 0.441340 -0.455268
C -4.571555 0.040446 0.844944
C -5.686123 -0.970788 0.588167
H 0.926691 0.592218 1.415135
H 1.944895 0.702339 -1.408967
H 0.012015 -1.776163 1.368355
H 3.585844 -1.524438 -0.618532
H -0.603601 -2.339229 -1.191203
H 1.788135 -2.180746 -2.524571
H -1.668676 0.434596 1.265368
H -3.121790 2.312979 0.420411
H -2.483524 1.957551 -1.214145
H -3.441090 -0.454757 -0.951904
H -4.604055 0.847997 -1.173131
H 3.451711 2.417639 1.647768
H -4.991476 0.940054 1.337736
H -3.843225 -0.385083 1.561517
H -5.303621 -1.889971 0.129729
H -6.187081 -1.254455 1.521050
H -6.453166 -0.566758 -0.083082


%chk=000245793-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245793

0 1
O 1.991625 -1.878843 0.807068
O -0.326420 1.004259 -1.676616
O 2.511526 2.062068 1.161001
O 4.358469 0.931402 0.335669
N -1.561377 0.967116 0.299363
C 0.710995 0.040664 0.340467
C 2.106097 0.193954 -0.340842
C 0.586895 -1.549448 0.421566
C 2.593227 -1.310044 -0.444254
C 0.499418 -2.110015 -1.001785
C 1.743933 -1.968285 -1.532609
C -0.419181 0.718828 -0.442312
C 3.115083 1.048352 0.399635
C -2.773313 1.574085 -0.280411
C -3.944626 0.577189 -0.441999
C -4.469327 -0.000380 0.892677
C -5.681669 -0.936885 0.700960
H 0.745565 0.423712 1.373869
H 1.964011 0.636128 -1.348036
H -0.113138 -1.929454 1.176460
H 3.679814 -1.449926 -0.446598
H -0.412438 -2.457779 -1.488640
H 2.076977 -2.171611 -2.551280
H -1.554143 0.740730 1.295398
H -3.088427 2.424189 0.356925
H -2.474826 1.973793 -1.264863
H -3.626540 -0.247386 -1.109874
H -4.771905 1.104595 -0.959439
H 3.225401 2.617158 1.578786
H -4.750236 0.834977 1.567445
H -3.656662 -0.559525 1.400967
H -5.422570 -1.792806 0.049895
H -6.037630 -1.341337 1.665996
H -6.524804 -0.399776 0.227511


