%chk=000220579.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220579

0 1
O 2.541396 1.235885 0.239364
O 2.561751 -1.873889 1.209337
O 4.227450 0.244243 -0.892747
O -3.696039 -2.113826 0.005436
O -1.580942 -2.164058 -0.403308
N -2.620287 -1.562726 -0.163984
C 0.615546 -0.273638 -1.031206
C 2.044251 -0.820812 -0.890833
C -0.063299 0.000464 0.320525
C -1.404449 0.640251 0.122035
C 2.081152 -1.992912 0.109168
C 3.073720 0.234703 -0.532751
C -2.591021 -0.090637 -0.090921
C -1.492621 2.045933 0.159838
C 1.469343 -3.261866 -0.387184
C -3.830472 0.569742 -0.238731
C -2.712900 2.696178 0.001194
C -3.889634 1.956325 -0.196361
C 3.446766 2.296719 0.692811
C 3.692167 3.280575 -0.431120
H 0.641752 0.658322 -1.632113
H 0.003238 -1.004660 -1.604826
H 2.361726 -1.217235 -1.896992
H -0.156888 -0.944000 0.902135
H 0.600372 0.650102 0.941801
H -0.581877 2.628103 0.316880
H 1.632956 -4.087382 0.323879
H 1.863015 -3.582198 -1.358742
H 0.372403 -3.162528 -0.500897
H -4.740241 -0.025102 -0.384152
H -2.758601 3.786663 0.032592
H -4.844370 2.468678 -0.313329
H 2.863160 2.719699 1.530006
H 4.377739 1.827844 1.060598
H 2.754670 3.633477 -0.876680
H 4.283297 2.818484 -1.237620
H 4.249570 4.157576 -0.080702


%chk=000220579-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220579

0 1
O 2.596731 1.316850 0.190663
O 2.599857 -1.866841 1.265225
O 4.337504 0.119524 -0.789263
O -3.952396 -2.136351 0.137577
O -1.771605 -2.256935 -0.489890
N -2.820650 -1.582181 -0.141844
C 0.604793 -0.281773 -1.023944
C 2.068268 -0.809063 -0.886118
C -0.140708 -0.075204 0.325579
C -1.497977 0.577306 0.119881
C 2.131635 -2.004699 0.107353
C 3.122927 0.232133 -0.509638
C -2.735952 -0.100577 -0.082523
C -1.566928 1.996905 0.150248
C 1.562759 -3.319818 -0.396658
C -3.967392 0.584657 -0.231348
C -2.777836 2.698452 -0.019698
C -3.988491 1.989427 -0.209838
C 3.582579 2.348342 0.650340
C 3.822840 3.394890 -0.440645
H 0.636290 0.676390 -1.574313
H 0.029825 -0.998118 -1.636670
H 2.379080 -1.193650 -1.876832
H -0.243754 -1.046700 0.836978
H 0.475739 0.579640 0.963406
H -0.636176 2.549683 0.320905
H 1.680077 -4.098264 0.372680
H 2.078427 -3.634196 -1.323254
H 0.488667 -3.210739 -0.638767
H -4.882333 0.000571 -0.360705
H -2.781173 3.793454 0.005388
H -4.934536 2.524867 -0.336145
H 3.105298 2.779365 1.545054
H 4.517383 1.832362 0.928639
H 2.874082 3.859776 -0.761314
H 4.314388 2.940596 -1.316876
H 4.482558 4.192414 -0.051232


