%chk=000212789.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212789

0 1
O -4.017950 -0.882712 0.151814
O -6.090277 -0.802579 1.580996
N -0.470542 -0.797473 -0.319896
N 2.346479 -0.376207 -0.789273
N 4.089891 1.241751 -0.365595
N 4.375508 -1.454329 -2.972353
N 6.236579 1.258261 -1.535726
N 6.451733 -0.527285 -3.281123
C 0.193737 -1.307266 -1.563849
C 0.508777 -0.791775 0.815926
C 1.363917 -0.370342 -1.924240
C 1.698351 0.123492 0.470176
C -1.685845 -1.605818 0.011498
C 3.613599 0.199341 -1.092794
C -2.886221 -1.013951 -0.745364
C 4.463070 -0.376108 -2.081924
C 5.786240 0.194820 -2.279441
C 5.371497 1.710816 -0.609629
C -4.031183 0.180980 1.031529
C 5.600507 -1.502102 -3.665117
C -5.213448 0.227716 1.839880
C -3.045769 1.147147 1.180353
C -5.377393 1.245160 2.771646
C -3.225565 2.173298 2.127618
C -4.371604 2.221484 2.909373
C -7.326226 -0.819512 2.335888
H -0.550868 -1.295155 -2.388933
H 0.560760 -2.352038 -1.463279
H 0.876386 -1.808149 1.076493
H -0.006095 -0.384529 1.715162
H 1.850137 -0.711583 -2.858623
H 0.976016 0.658218 -2.115532
H 1.363857 1.181012 0.372607
H 2.447464 0.098047 1.293847
H -1.899642 -1.548158 1.105380
H -1.576814 -2.687440 -0.209874
H -3.306264 -1.712887 -1.492049
H -2.660942 -0.042682 -1.221213
H 3.610669 -2.101689 -3.015044
H 5.692010 2.555516 0.024070
H 5.813367 -2.245278 -4.426053
H -2.137897 1.121908 0.576492
H -6.265052 1.302308 3.393558
H -2.451887 2.930579 2.237614
H -4.506070 3.017093 3.639608
H -7.914123 0.078642 2.127523
H -7.120621 -0.935820 3.403412
H -7.817954 -1.713525 1.930258


%chk=000212789-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212789

0 1
O -3.952740 -1.127861 0.250180
O -6.212309 -1.016381 1.622428
N -0.312598 -0.650357 -0.085683
N 2.403903 0.002010 -0.785053
N 4.552600 0.673399 -0.074945
N 4.083821 -1.083889 -3.382088
N 6.620369 0.431021 -1.370322
N 6.336483 -0.723503 -3.540152
C 0.250743 -1.057240 -1.396012
C 0.754644 -0.595673 0.949725
C 1.355713 -0.069620 -1.819135
C 1.864083 0.388048 0.538806
C -1.467750 -1.485134 0.326532
C 3.766973 0.102816 -1.045052
C -2.719622 -1.211557 -0.549186
C 4.434654 -0.372379 -2.219925
C 5.854646 -0.171337 -2.334686
C 5.901882 0.797114 -0.278884
C -4.148250 0.041157 1.006616
C 5.256843 -1.259251 -4.124013
C -5.377332 0.102822 1.739305
C -3.240054 1.122223 1.070913
C -5.670878 1.249885 2.510114
C -3.547334 2.266652 1.848362
C -4.757688 2.331655 2.563629
C -7.477923 -0.982435 2.357264
H -0.551631 -1.047019 -2.156401
H 0.676655 -2.093337 -1.356824
H 1.209011 -1.602213 1.126956
H 0.302307 -0.252554 1.898147
H 1.775681 -0.358163 -2.794219
H 0.898111 0.935361 -1.945364
H 1.448793 1.416246 0.489698
H 2.693672 0.389887 1.261214
H -1.715359 -1.224851 1.371025
H -1.221319 -2.574419 0.315453
H -2.928658 -2.037358 -1.247962
H -2.573774 -0.273873 -1.122336
H 3.171738 -1.462499 -3.627364
H 6.460054 1.257627 0.541955
H 5.262686 -1.784329 -5.077348
H -2.287542 1.077702 0.531284
H -6.608948 1.310323 3.069951
H -2.834477 3.097027 1.888035
H -4.999651 3.213806 3.165707
H -8.121841 -0.147759 2.016652
H -7.310308 -0.898088 3.449179
H -7.963776 -1.942507 2.129621


