%chk=000256684.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256684

0 1
O 2.986289 0.934133 0.263933
O 2.534749 -2.194352 1.573206
O 4.514906 -1.950880 -1.101619
O 6.493363 0.920536 -0.649943
O 2.123579 0.777075 -2.201227
O -2.399979 1.203284 -2.547990
N 0.852448 0.040505 -0.388732
N -0.147268 1.003952 -2.364074
N -0.509751 -1.109697 1.291343
N -2.902610 -0.116318 -0.045860
N -1.419013 -2.194395 1.382414
N -3.299160 0.707996 1.037761
C 2.730619 -1.466318 0.372120
C 2.031506 -0.079625 0.534033
C 4.198263 -1.133138 0.022469
C 4.173197 0.363027 -0.378535
C 5.340414 1.201663 0.148157
C -0.446125 -0.330786 0.088413
C 1.033465 0.631372 -1.689195
C -1.564928 0.139587 -0.568188
C -1.475335 0.822881 -1.857779
C -1.220874 -3.265068 0.413467
C -3.442135 2.136642 0.884298
C -2.289709 -3.683972 -0.396992
C 0.013056 -3.936476 0.374275
C -3.308683 2.933971 2.040587
C -3.827888 2.722068 -0.333435
C -2.120776 -4.786353 -1.237573
C 0.167980 -5.029568 -0.480339
C -0.894005 -5.456675 -1.285073
C -3.577151 4.300833 1.969075
C -4.084669 4.093274 -0.385916
C -3.962625 4.887056 0.758810
H 2.271346 -2.122194 -0.412665
H 1.695929 0.137579 1.581920
H 4.903714 -1.360227 0.848588
H 4.033026 0.475129 -1.483912
H 5.094118 2.280184 0.129917
H 5.655504 0.922305 1.170799
H 3.176052 -1.941959 2.273644
H 5.437962 -1.768903 -1.401114
H -0.036044 1.438632 -3.293775
H 0.406011 -1.430760 1.672475
H 6.439106 1.391704 -1.510517
H -3.596607 -0.017652 -0.817506
H -2.399878 -1.838316 1.359110
H -2.739481 0.460975 1.873771
H -3.241908 -3.153598 -0.373174
H 0.837883 -3.627353 1.020335
H -3.012489 2.489922 2.987321
H -3.927656 2.123882 -1.241555
H -2.948189 -5.119662 -1.863741
H 1.122454 -5.555020 -0.515435
H -0.765564 -6.310908 -1.947397
H -3.482131 4.915551 2.863486
H -4.383316 4.545371 -1.331935
H -4.166393 5.953286 0.708767


%chk=000256684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256684

0 1
O 2.993638 0.975573 0.183320
O 2.775264 -2.383402 -1.007891
O 5.743470 -1.058144 -1.244180
O 6.729459 1.107411 0.496285
O 2.639147 1.895226 -2.461473
O -1.973387 2.400885 -3.040949
N 1.185670 0.392490 -1.377585
N 0.327229 2.102984 -2.748841
N -0.058192 -1.561260 -0.936815
N -2.562281 -0.019978 -1.670704
N -1.181358 -2.408450 -1.064115
N -3.156141 -0.087684 -0.371277
C 3.291640 -1.017966 -1.169585
C 2.255263 -0.104274 -0.470616
C 4.595684 -0.682050 -0.438953
C 4.424391 0.845762 -0.226451
C 5.322877 1.399417 0.878071
C -0.091252 -0.231583 -1.347915
C 1.465382 1.496340 -2.220949
C -1.214455 0.493288 -1.768846
C -1.026570 1.726200 -2.515387
C -1.699056 -3.054044 0.089342
C -3.296286 1.009805 0.509305
C -2.940007 -3.742554 -0.032411
C -1.004535 -3.074493 1.327827
C -3.549913 0.737944 1.885109
C -3.250062 2.358399 0.061483
C -3.474120 -4.431779 1.075066
C -1.552622 -3.772494 2.425823
C -2.786306 -4.454245 2.312501
C -3.761991 1.797048 2.789626
C -3.455012 3.406413 0.985288
C -3.713812 3.142252 2.350075
H 3.405609 -0.759482 -2.239065
H 1.737651 -0.670978 0.323989
H 4.608786 -1.186433 0.552847
H 4.571358 1.380867 -1.184704
H 5.162679 2.482055 1.034983
H 5.154517 0.867764 1.828518
H 3.362257 -3.025272 -1.477420
H 6.537941 -0.652565 -0.800298
H 0.481998 2.915619 -3.352552
H 0.850297 -2.059939 -0.990121
H 7.071952 1.839363 -0.074896
H -3.178059 0.471479 -2.335641
H -1.858228 -2.064822 -1.758822
H -3.157213 -1.024918 0.034337
H -3.471991 -3.744393 -0.991688
H -0.058233 -2.534905 1.429318
H -3.578234 -0.301891 2.236511
H -3.070384 2.587926 -0.994058
H -4.431671 -4.953868 0.969530
H -1.010936 -3.778198 3.378551
H -3.204315 -4.992447 3.169178
H -3.959659 1.570541 3.843997
H -3.418136 4.441822 0.626727
H -3.875141 3.963840 3.055900


