%chk=000273042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273042

0 1
O -2.220826 -0.766358 -1.672090
O 2.237067 -0.731152 -1.666185
O -3.637096 -1.704920 -0.187717
O 3.663948 -1.645412 -0.176793
N 0.024447 -3.348743 1.564770
N -0.024940 2.740204 1.776135
C 0.009171 -1.135225 -0.245671
C -1.242796 -1.900408 0.125389
C 1.272235 -1.880148 0.128938
C -0.002726 0.222905 0.451229
C -1.215550 -2.911749 1.038358
C 1.258707 -2.891840 1.041819
C -0.011175 1.437102 -0.317618
C -0.005599 0.310164 1.825619
C -2.489691 -1.478570 -0.523676
C 2.514043 -1.438200 -0.516489
C -2.393367 -3.663746 1.550121
C 2.447119 -3.624851 1.556637
C -0.022234 2.676615 0.385346
C -0.009101 1.468269 -1.747270
C -0.016844 1.595174 2.452759
C -0.031003 3.912763 -0.342735
C -0.017583 2.660702 -2.424814
C -0.028677 3.897284 -1.713240
C -3.353086 -0.161199 -2.377758
C 3.361429 -0.107773 -2.368602
C -3.665710 1.177786 -1.744628
C 3.651479 1.235591 -1.734006
H 0.009549 -0.984999 -1.369247
H 0.029521 -4.098982 2.253055
H 0.000519 -0.581138 2.446977
H -2.425813 -3.718582 2.646676
H -2.439313 -4.687685 1.151656
H -3.350410 -3.176376 1.247240
H 2.475851 -3.682665 2.653116
H 3.396851 -3.120114 1.259263
H 2.512443 -4.646594 1.155176
H -0.000506 0.508429 -2.279117
H -0.019110 1.665056 3.547834
H -0.039397 4.843198 0.226611
H -0.015991 2.684194 -3.512669
H -0.035247 4.826910 -2.281192
H -2.940927 -0.077195 -3.399210
H -4.208511 -0.859798 -2.352001
H 4.227604 -0.792918 -2.341060
H 2.950550 -0.029669 -3.391040
H -4.368507 1.758507 -2.351798
H -4.110184 1.055574 -0.746482
H -2.754038 1.780977 -1.614246
H 4.345128 1.828366 -2.340047
H 2.729888 1.823613 -1.603957
H 4.097009 1.119826 -0.735564


%chk=000273042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273042

0 1
O -2.283864 -0.657187 -1.663970
O 2.299949 -0.622196 -1.656418
O -3.688087 -1.989094 -0.368467
O 3.720696 -1.930199 -0.354494
N 0.022635 -3.228438 1.603818
N -0.020155 2.795742 1.801753
C 0.009574 -1.116153 -0.302598
C -1.259713 -1.907313 0.070649
C 1.289611 -1.887704 0.074945
C -0.001887 0.275183 0.376674
C -1.221430 -2.874872 1.058475
C 1.262940 -2.855882 1.062488
C -0.011589 1.522365 -0.354918
C -0.002334 0.348845 1.776992
C -2.522528 -1.565750 -0.616624
C 2.549427 -1.526063 -0.607614
C -2.377971 -3.668251 1.624535
C 2.429645 -3.631844 1.631815
C -0.020203 2.759868 0.411272
C -0.013027 1.618648 -1.787013
C -0.011603 1.610755 2.441314
C -0.029252 4.020144 -0.270858
C -0.021907 2.860455 -2.424982
C -0.030016 4.073821 -1.664865
C -3.483248 -0.177837 -2.411601
C 3.493715 -0.122036 -2.399171
C -4.105655 1.035450 -1.714288
C 4.088760 1.104436 -1.701120
H 0.010384 -0.971888 -1.390281
H 0.026879 -3.943209 2.333623
H 0.004730 -0.564562 2.379896
H -2.342926 -3.659784 2.731602
H -2.324742 -4.723846 1.293805
H -3.335338 -3.251630 1.286704
H 2.388821 -3.628047 2.738699
H 3.381647 -3.198182 1.300305
H 2.395790 -4.686963 1.297038
H -0.007517 0.705081 -2.385464
H -0.011800 1.653560 3.537640
H -0.035434 4.922517 0.348336
H -0.022783 2.909200 -3.519866
H -0.036906 5.040419 -2.180840
H -3.083740 0.078903 -3.406385
H -4.204283 -1.010198 -2.491440
H 4.230859 -0.940680 -2.473665
H 3.094409 0.125086 -3.396465
H -4.938909 1.429695 -2.325828
H -4.506925 0.754508 -0.726264
H -3.359475 1.837829 -1.583653
H 4.915753 1.515354 -2.310160
H 3.325387 1.891079 -1.573965
H 4.492236 0.833065 -0.711303


