%chk=000252668.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252668

0 1
O -2.303668 1.147724 1.384301
O -3.392862 -3.339492 0.301781
O -2.908276 -2.392985 -1.665672
N -1.061617 2.191437 -0.229328
N 0.039246 -0.410571 -0.648981
C 0.214340 3.876674 1.127421
C 1.323264 4.227427 0.128331
C -1.415024 -0.264209 -0.385190
C -1.111363 3.513311 0.442437
C 2.607059 4.660687 0.849062
C -1.616708 1.072851 0.375486
C 3.722323 5.005289 -0.148090
C -2.060805 -1.407343 0.419765
C 0.375289 -1.437613 -1.677093
C 5.001477 5.438776 0.564238
C 0.625439 -2.822501 -1.126489
C -2.789560 -2.366095 -0.460492
C 1.676217 -3.041942 -0.222805
C -0.175463 -3.898548 -1.532552
C 1.912869 -4.324578 0.278140
C 0.067822 -5.181053 -1.032959
C 1.109135 -5.396201 -0.124952
H 0.540194 3.043534 1.781867
H 0.037991 4.732765 1.809551
H 1.536932 3.357469 -0.522260
H 0.981594 5.035295 -0.547559
H -1.949779 -0.169598 -1.376537
H -1.385330 4.274275 -0.322047
H -1.935104 3.501482 1.199151
H 2.401344 5.534462 1.497053
H 2.948447 3.857248 1.529938
H 3.383367 5.810440 -0.829151
H 3.933185 4.131081 -0.794768
H -0.355668 2.079546 -0.957555
H -2.767916 -0.988214 1.189932
H -1.313254 -1.954179 1.036827
H 0.543235 -0.605515 0.225296
H 1.299185 -1.069877 -2.188667
H -0.415447 -1.460676 -2.463693
H 4.837535 6.327495 1.184379
H 5.386819 4.649386 1.219599
H 5.791847 5.682575 -0.154626
H 2.317126 -2.216857 0.082555
H -0.992682 -3.735526 -2.239251
H 2.727950 -4.490776 0.980928
H -0.555751 -6.014444 -1.353434
H 1.295883 -6.394845 0.265156
H -3.896039 -3.999894 -0.245542


%chk=000252668-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252668

0 1
O -2.682346 1.460151 1.122919
O -2.289313 -3.580750 1.230374
O -3.100699 -2.662105 -0.739845
N -1.035305 2.172798 -0.380122
N -0.143889 -0.311699 -0.833022
C -0.012349 4.181575 0.749186
C 1.375295 4.096189 0.074728
C -1.507013 -0.234147 -0.257470
C -1.166081 3.611411 -0.110350
C 2.504903 4.704486 0.936480
C -1.790657 1.216641 0.248531
C 3.897113 4.619679 0.269995
C -1.874524 -1.239441 0.865830
C 0.138020 -1.321496 -1.891564
C 5.018258 5.230376 1.138476
C 0.461910 -2.744005 -1.419061
C -2.476104 -2.519024 0.338523
C 1.580015 -2.979345 -0.575919
C -0.314850 -3.851971 -1.838405
C 1.905851 -4.285876 -0.150883
C 0.011646 -5.163455 -1.421598
C 1.120662 -5.384566 -0.573508
H 0.006074 3.648200 1.719823
H -0.245060 5.242846 0.973289
H 1.619977 3.035092 -0.142205
H 1.341146 4.618222 -0.905229
H -2.219781 -0.404064 -1.090486
H -1.215897 4.152769 -1.076058
H -2.129002 3.749273 0.412639
H 2.268418 5.767077 1.154291
H 2.536447 4.187212 1.918204
H 3.863550 5.137351 -0.710508
H 4.133012 3.557637 0.052241
H -0.333234 1.790626 -1.029028
H -2.636146 -0.738194 1.501889
H -1.013898 -1.473732 1.515525
H 0.580369 -0.314902 -0.100438
H 0.997962 -0.941980 -2.479360
H -0.733141 -1.341643 -2.570036
H 4.821179 6.299335 1.344943
H 5.093172 4.710334 2.112222
H 6.002587 5.158658 0.640293
H 2.213161 -2.139010 -0.258708
H -1.187246 -3.686465 -2.481105
H 2.772406 -4.449672 0.499790
H -0.597621 -6.009274 -1.760551
H 1.374679 -6.399829 -0.248725
H -2.698859 -4.403599 0.847494


