%chk=000233734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233734

0 1
O -0.409660 -1.780236 -2.211032
N 0.428104 -0.017508 -1.024185
C -1.831450 0.926510 -0.394821
C -2.662575 -0.370170 -0.324438
C -0.732730 0.806592 -1.478962
C -2.741625 2.132877 -0.708619
C -3.472237 -0.469693 0.974054
C 1.404110 0.520609 -0.167418
C -4.316711 -1.751332 1.008933
C -2.073232 3.478688 -0.442153
C 0.477432 -1.389185 -1.470787
C 2.484924 -0.296085 0.271728
C 2.556991 -1.682040 -0.167414
C 1.599741 -2.177323 -0.992242
C 1.338093 1.879367 0.259719
C -5.121494 -1.863717 2.301900
C 3.461285 0.273171 1.126132
C 3.683805 -2.546919 0.292771
C 2.310125 2.396168 1.091327
C 3.383211 1.591193 1.533053
H -1.344136 1.091518 0.597431
H -3.333884 -0.440540 -1.201869
H -1.992784 -1.250894 -0.414558
H -0.367813 1.810189 -1.787762
H -1.154639 0.328383 -2.398932
H -3.662473 2.055344 -0.092934
H -3.088680 2.083149 -1.758953
H -2.791020 -0.446857 1.846354
H -4.129153 0.415357 1.081895
H -3.659861 -2.636820 0.898061
H -5.000967 -1.775474 0.138286
H -1.736980 3.564180 0.597741
H -1.204457 3.641373 -1.089878
H -2.770772 4.305026 -0.625723
H 1.608950 -3.207645 -1.350587
H 0.516011 2.513150 -0.071929
H -5.811126 -1.020978 2.422962
H -5.719298 -2.781903 2.316350
H -4.469340 -1.883233 3.182315
H 4.292614 -0.345176 1.468378
H 4.656724 -2.143885 -0.026052
H 3.620238 -3.570147 -0.106190
H 3.701096 -2.636230 1.389271
H 2.256327 3.436444 1.415714
H 4.138615 2.016402 2.189066


%chk=000233734-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233734

0 1
O -0.336758 -1.684758 -2.471214
N 0.440617 0.010952 -1.030854
C -1.842870 1.003809 -0.436914
C -2.588054 -0.345433 -0.249121
C -0.691207 0.868523 -1.474619
C -2.805204 2.139040 -0.889705
C -3.469344 -0.407747 1.019699
C 1.393819 0.487275 -0.110929
C -4.200141 -1.761395 1.176158
C -2.256730 3.569919 -0.684571
C 0.524141 -1.294545 -1.615767
C 2.481470 -0.362974 0.303119
C 2.583190 -1.710211 -0.251388
C 1.640095 -2.123214 -1.168550
C 1.313466 1.810671 0.416109
C -5.081084 -1.826724 2.442490
C 3.433298 0.142073 1.234573
C 3.710562 -2.631815 0.166650
C 2.273531 2.278718 1.327892
C 3.340736 1.444269 1.748661
H -1.410437 1.293886 0.544661
H -3.209454 -0.542931 -1.147242
H -1.851259 -1.170673 -0.207850
H -0.291006 1.859866 -1.752708
H -1.087782 0.388579 -2.386480
H -3.754618 2.043821 -0.329343
H -3.062364 1.986556 -1.958622
H -2.835708 -0.230171 1.914453
H -4.224189 0.405419 1.007258
H -3.450896 -2.578539 1.200293
H -4.825257 -1.942603 0.278152
H -2.021252 3.752582 0.381391
H -1.338050 3.755507 -1.272532
H -2.999302 4.326950 -0.996762
H 1.679908 -3.118733 -1.619934
H 0.502873 2.476868 0.115041
H -5.858157 -1.038985 2.425574
H -5.592018 -2.803160 2.531542
H -4.474040 -1.678144 3.355752
H 4.258467 -0.504108 1.550336
H 4.698479 -2.197620 -0.077403
H 3.631193 -3.604017 -0.346151
H 3.696030 -2.818911 1.257004
H 2.190899 3.300245 1.715266
H 4.083709 1.813587 2.462584


