%chk=000242396.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242396

0 1
O -0.837832 -0.377702 1.939139
N -1.096329 1.229393 -0.298751
N -0.513111 -0.060638 -0.334059
C -2.301886 1.282772 -1.206633
C -0.104015 2.290031 -0.714418
C -3.380450 0.316966 -0.775346
C 1.115383 2.299376 0.175670
C 0.338447 -2.094675 0.737717
C -0.378339 -0.756804 0.880914
C -4.191511 -0.275678 -1.755677
C 0.997740 2.112566 1.560998
C -3.612416 0.041102 0.579727
C 2.377182 2.535945 -0.390282
C 1.622944 -2.036800 -0.034555
C -5.229729 -1.132241 -1.378782
C 2.134156 2.162159 2.371205
C -4.648759 -0.819459 0.949142
C 3.510371 2.588985 0.426792
C 1.879910 -2.975876 -1.044182
C 2.580598 -1.053427 0.261385
C -5.461464 -1.405070 -0.027194
C 3.391749 2.402791 1.807310
C 3.086374 -2.930580 -1.749496
C 3.780948 -1.011198 -0.450190
C 4.037641 -1.949365 -1.456214
H -2.042930 1.125533 -2.276701
H -2.714475 2.317875 -1.120403
H -0.627850 3.270359 -0.594323
H 0.190006 2.213644 -1.784165
H -0.008313 -0.360373 -1.172231
H 0.546597 -2.476436 1.766895
H -0.372537 -2.831876 0.305606
H -4.019420 -0.072831 -2.809664
H 0.014712 1.901622 1.999936
H -2.961752 0.481746 1.345498
H 2.481816 2.679644 -1.463147
H -5.858509 -1.587965 -2.140994
H 2.037030 2.012742 3.446004
H -4.820687 -1.033942 2.003056
H 4.486830 2.778338 -0.014746
H 1.146875 -3.744981 -1.278345
H 2.387362 -0.315315 1.043354
H -6.270002 -2.071381 0.264152
H 4.274152 2.446249 2.442013
H 3.284087 -3.664334 -2.529449
H 4.517474 -0.242242 -0.218334
H 4.975431 -1.916249 -2.006434


%chk=000242396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242396

0 1
O -0.791997 -0.307451 2.129563
N -0.929981 1.231494 -0.298777
N -0.271190 -0.017518 -0.143043
C -2.059512 1.154276 -1.269028
C 0.029988 2.322439 -0.640767
C -3.163995 0.189512 -0.861482
C 1.117013 2.534588 0.403191
C 0.572907 -2.019071 1.026103
C -0.222728 -0.691039 1.070578
C -3.879284 -0.514365 -1.862019
C 0.829258 2.455431 1.789074
C -3.537268 0.028229 0.496345
C 2.429869 2.871849 -0.009864
C 1.591175 -2.177065 -0.093028
C -4.960579 -1.357373 -1.518062
C 1.839657 2.714892 2.741060
C -4.612557 -0.820242 0.840894
C 3.440133 3.139436 0.942545
C 1.410310 -3.141629 -1.117757
C 2.754049 -1.358843 -0.128381
C -5.331664 -1.511667 -0.162456
C 3.146442 3.062517 2.323578
C 2.363954 -3.290008 -2.151962
C 3.707172 -1.504690 -1.159469
C 3.516261 -2.471774 -2.175664
H -1.697992 0.892759 -2.295130
H -2.469648 2.182443 -1.330709
H -0.581885 3.241762 -0.735693
H 0.505220 2.148431 -1.639006
H 0.258202 -0.406904 -0.937957
H 1.058459 -2.090088 2.015912
H -0.178456 -2.830385 0.986729
H -3.590476 -0.403970 -2.915560
H -0.173519 2.154426 2.109199
H -2.958718 0.538424 1.273297
H 2.664636 2.925165 -1.080958
H -5.506446 -1.893907 -2.302667
H 1.606682 2.640320 3.809139
H -4.884661 -0.944704 1.895065
H 4.450301 3.403111 0.608698
H 0.519948 -3.782280 -1.101977
H 2.907188 -0.603525 0.652667
H -6.167121 -2.167215 0.108851
H 3.927374 3.266133 3.065174
H 2.209393 -4.043844 -2.932219
H 4.599058 -0.868003 -1.168844
H 4.258526 -2.587677 -2.973385


