%chk=000256233.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256233

0 1
O 6.212850 2.377061 0.726981
O 4.957250 -2.807108 -0.532202
O -5.446101 0.375443 -0.424763
N 6.005734 1.136857 0.113995
N 5.305576 -1.697647 -0.241198
C 2.843409 -0.725918 -0.370212
C 2.381356 0.504816 0.506298
C 2.089987 -1.950644 0.163582
C 0.074481 -0.385122 0.662059
C 0.940725 0.782317 0.212496
C 0.572315 -1.723675 0.047966
C 3.501496 1.545328 0.296145
C 4.355186 -0.664028 -0.151143
C 2.584556 -0.537726 -1.871847
C 4.710136 0.643696 0.126548
C -1.396440 -0.186993 0.369570
C 0.470655 1.885207 -0.374914
C -0.975186 2.095495 -0.690927
C -1.883789 0.974005 -0.267937
C -2.305112 -1.176329 0.769963
C -3.252614 1.116851 -0.514655
C -3.677057 -1.055211 0.535686
C -4.134032 0.098014 -0.113506
C -6.460754 -0.612366 -0.060321
C -7.736030 0.006236 -0.543937
C -8.922894 -0.577261 -0.405355
H 2.440916 0.200452 1.587586
H 2.377403 -2.157475 1.210340
H 2.387239 -2.856342 -0.402640
H 0.182753 -0.455490 1.779423
H 0.276378 -1.754932 -1.020328
H 0.043680 -2.565917 0.531927
H 3.596276 2.257980 1.130365
H 3.345842 2.158083 -0.615081
H 2.953627 -1.403129 -2.435528
H 1.515642 -0.427734 -2.090337
H 3.088869 0.348659 -2.268367
H 1.123357 2.704702 -0.669581
H -1.085253 2.259338 -1.788487
H -1.320270 3.042517 -0.214891
H 6.806637 0.517145 0.245936
H -1.939586 -2.069566 1.279665
H -3.653766 1.998335 -1.008709
H -4.351052 -1.840217 0.855017
H 6.184422 2.257939 1.734899
H -6.227297 -1.562928 -0.574224
H -6.442459 -0.747484 1.036675
H -7.603949 0.982650 -1.022464
H -9.842440 -0.128474 -0.755750
H -9.077068 -1.538711 0.062379


%chk=000256233-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256233

0 1
O 6.292985 2.464981 0.667307
O 5.166596 -2.720984 -0.667864
O -5.576134 0.358022 -0.502458
N 5.968382 1.050874 0.790330
N 5.466117 -1.537388 -0.189853
C 2.918317 -0.747904 -0.362497
C 2.374546 0.460830 0.501621
C 2.122062 -2.006315 0.063255
C 0.053128 -0.460416 0.543707
C 0.929112 0.738935 0.177688
C 0.596435 -1.776440 -0.130835
C 3.485245 1.540912 0.425603
C 4.407173 -0.656349 -0.004093
C 2.791587 -0.509877 -1.897106
C 4.717684 0.656993 0.409509
C -1.432653 -0.239684 0.258740
C 0.452133 1.869422 -0.401350
C -0.997199 2.084410 -0.770187
C -1.923225 0.944542 -0.361982
C -2.369037 -1.230427 0.643069
C -3.308963 1.090330 -0.595781
C -3.754296 -1.091314 0.417807
C -4.225225 0.085129 -0.216996
C -6.565861 -0.682922 -0.151249
C -7.908301 -0.206125 -0.636819
C -9.030424 -0.197472 0.122806
H 2.403897 0.081144 1.548597
H 2.335162 -2.228017 1.128808
H 2.452900 -2.884949 -0.517657
H 0.173444 -0.616229 1.641550
H 0.349101 -1.744050 -1.208397
H 0.048398 -2.642904 0.285040
H 3.470486 2.252422 1.268930
H 3.441254 2.137901 -0.506783
H 3.247970 -1.360262 -2.433956
H 1.739257 -0.415417 -2.212853
H 3.317133 0.410474 -2.211602
H 1.141323 2.692873 -0.635877
H -1.077464 2.251343 -1.866486
H -1.359836 3.029244 -0.312254
H 6.752446 0.423454 0.554212
H -2.009507 -2.139044 1.141088
H -3.701521 1.995869 -1.072013
H -4.437726 -1.881868 0.740623
H 6.464353 2.765541 1.601485
H -6.280767 -1.630929 -0.657961
H -6.572662 -0.854299 0.944183
H -7.938993 0.123633 -1.683934
H -9.995276 0.120949 -0.286016
H -9.017950 -0.507942 1.175099


