%chk=000279478.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279478

0 1
O -1.254431 1.142255 -1.211131
O 1.552516 -0.723317 0.030568
O 0.479145 -1.415864 -1.833002
N 3.938855 0.810940 1.021323
C -1.207013 0.727850 0.161255
C -0.124656 1.618034 0.795858
C -2.584235 0.912744 0.828473
C -0.771996 -0.788651 0.213524
C -0.562700 3.084518 0.853019
C -2.984366 2.392586 0.878077
C -1.909421 3.240004 1.571350
C 2.866252 -0.784874 -0.633184
C -1.900373 -1.733966 -0.115956
C 0.424374 -1.019358 -0.692413
C 2.974883 0.282591 -1.720960
C 3.852565 -0.604208 0.533799
C 3.038701 1.681469 -1.109043
C 4.188958 1.777555 -0.097379
C -2.570551 -2.388055 0.931146
C -2.305249 -1.956698 -1.440488
C 5.017095 0.920580 2.050482
C -3.639469 -3.243458 0.652950
C -3.374268 -2.813882 -1.712675
C -4.046740 -3.455434 -0.668099
H 0.124715 1.247842 1.807568
H 0.827964 1.531835 0.210281
H -3.359096 0.336965 0.287042
H -2.557849 0.494988 1.852646
H -0.427618 -0.982705 1.268573
H -0.644945 3.477077 -0.181808
H 0.214366 3.686807 1.358064
H -3.953393 2.501235 1.398256
H -3.137815 2.764663 -0.155481
H -1.811790 2.939141 2.631205
H -2.213287 4.302944 1.580097
H 2.944185 -1.808425 -1.065488
H -1.964233 0.680865 -1.699897
H 2.107782 0.203269 -2.412805
H 3.870291 0.085961 -2.341204
H 3.487970 -1.212007 1.396550
H 4.835929 -1.020977 0.223805
H 3.150135 2.449613 -1.893561
H 2.068162 1.893384 -0.589568
H 5.163575 1.618832 -0.605167
H 4.215107 2.798182 0.343135
H -2.259954 -2.233629 1.962621
H -1.756941 -1.488270 -2.263722
H 4.785700 0.243459 2.888440
H 5.013212 1.944150 2.459369
H 6.031670 0.695211 1.691480
H -4.155014 -3.748316 1.468392
H -3.679123 -2.985971 -2.744187
H -4.879583 -4.121883 -0.882330


%chk=000279478-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279478

0 1
O -2.383654 0.975516 -1.290278
O 1.543406 -0.371494 -0.075383
O 0.359680 -0.678075 -2.062356
N 4.269158 0.116112 1.140108
C -1.624020 0.927436 -0.029856
C -0.641342 2.118697 -0.109280
C -2.590939 1.089230 1.178042
C -0.839242 -0.459010 0.115441
C -1.371949 3.481304 -0.103980
C -3.320951 2.451663 1.156366
C -2.311319 3.621955 1.115383
C 2.833840 -0.424005 -0.847094
C -1.762730 -1.664634 -0.062681
C 0.367052 -0.518826 -0.818911
C 3.154763 0.958911 -1.444222
C 3.915054 -0.902140 0.129837
C 3.542642 1.969420 -0.344332
C 4.679354 1.400488 0.528039
C -2.233970 -2.360251 1.081449
C -2.197584 -2.091873 -1.347960
C 5.247345 -0.394689 2.115758
C -3.125881 -3.447765 0.953153
C -3.090619 -3.180987 -1.474315
C -3.562544 -3.859437 -0.327687
H 0.057808 2.057073 0.748242
H -0.044732 2.023119 -1.035586
H -3.323990 0.259271 1.177292
H -2.005720 1.002810 2.117045
H -0.432987 -0.465554 1.142149
H -1.965759 3.567699 -1.033421
H -0.624335 4.298208 -0.112582
H -3.979376 2.532590 2.042875
H -3.967462 2.499304 0.258754
H -1.710586 3.623892 2.049583
H -2.847390 4.589709 1.075080
H 2.694607 -1.164506 -1.656843
H -2.985911 0.185953 -1.327003
H 2.298533 1.310101 -2.045954
H 4.006481 0.827547 -2.143243
H 3.560307 -1.811305 0.648487
H 4.806113 -1.196694 -0.491429
H 3.862571 2.925793 -0.799162
H 2.668830 2.173248 0.301253
H 5.603848 1.279122 -0.101311
H 4.927792 2.107774 1.341263
H -1.894149 -2.050652 2.077395
H -1.791023 -1.600545 -2.237884
H 4.846441 -1.299292 2.607809
H 5.427586 0.366632 2.895714
H 6.236023 -0.660761 1.658949
H -3.475814 -3.974114 1.848418
H -3.411800 -3.502555 -2.471652
H -4.253455 -4.703812 -0.429675


